SCHEMBL15218534

SCHEMBL15218534

Cc1cc(NS(=O)(=O)c2ccc(OC(C)C)cc2)n(-c2cccc3cnccc23)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.44
▸ FFAR4 Q5NUL3 1/20 0.42
▸ NPY5R Q15761 1/20 0.40
▸ IDO1 P14902 1/20 0.39
▸ NR3C1 P04150 3/20 0.37
▸ P2RX7 Q99572 1/20 0.36
▸ SCN9A Q15858 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ CYP17A1 P05093 1/20 0.35
▸ HSD11B1 P28845 1/20 0.35
▸ CCR9 P51686 1/20 0.35
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15218531 0.89 CNR2 (0.39) POLBFFAR4NPY5RIDO1NR3C1
SCHEMBL15218540 0.88 ALDH1A1 (0.46) POLBALDH1A1NPY5RIDO1NR3C1
SCHEMBL15218527 0.84 ALDH1A1 (0.46) POLBALDH1A1IDO1KDM4ELMNA
SCHEMBL15209523 0.83 POLB (0.48) POLBALDH1A1FFAR4NPY5RNR3C1
SCHEMBL22667955 0.82 PHGDH (0.33) NPY5RNR3C1LMNA
SCHEMBL17663511 0.78 ALDH1A1 (0.39) POLBALDH1A1NPY5RIDO1NR3C1
SCHEMBL17737455 0.78 IDO1 (0.55) ALDH1A1FFAR4IDO1LMNAMEN1
SCHEMBL15218533 0.76 IDO1 (0.39) POLBNPY5RIDO1SCN9A
SCHEMBL22375467 0.76 ALDH1A1 (0.50) POLBALDH1A1LMNACYP17A1HSD11B1
SCHEMBL16558119 0.76 TRPV1 (0.41) ALDH1A1NPY5RNR3C1LMNAMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210322410-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASE USING A COMBINATION THERAPY OF SMALL MOLECULE INHIBITORS OF C-C CHEMOKINE RECEPTOR TYPE 9 (CCR9) AND ANTI-ALPHA4BETA7 INTEGRIN BLOCKING ANTIBODIES CHEMOCENTRYX INC (US) 2021-10-21 — — US disclosed
WO-2021202731-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASE USING CCR9 INHIBITOR AND ANTI-IL-23 BLOCKING ANTIBODIES CHEMOCENTRYX, INC. (US) 2021-10-07 — — WO disclosed
US-20210308119-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASE USING CCR9 INHIBITOR AND ANTI-IL-23 BLOCKING ANTIBODIES CHEMOCENTRYX, INC. 2021-10-07 — — US disclosed
US-11045469-B2 Compositions and methods for treating inflammatory bowel disease using a combination therapy of small molecule inhibitors of C-C chemokine receptor type 9 (CCR9) and anti-α4β7 integrin blocking antibodies CHEMOCENTRYX, INC. (US) 2021-06-29 — — US disclosed
US-11020394-B2 Compositions and methods for treating inflammatory bowel disease using a combination therapy of small molecule inhibitors of C—C chemokine receptor type 9 (CCR9) and anti-α4β7 integrin blocking antibodies CHEMOCENTRYX, INC. (US) 2021-06-01 — — US disclosed
EP-3738958-A1 AZA-ARYL 1H-PYRAZOL-1-YL BENZENE SULFONAMIDES AS CCR(9) ANTAGONISTS ChemoCentryx, Inc. (US) 2020-11-18 — — EP disclosed
US-20200268751-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASE USING A COMBINATION THERAPY OF SMALL MOLECULE INHIBITORS OF C-C CHEMOKINE RECEPTOR TYPE 9 (CCR9) AND ANTI-ALPHA4BETA7 INTEGRIN BLOCKING ANTIBODIES CHEMOCENTRYX INC (US) 2020-08-27 — — US disclosed
US-20200197386-A1 Aza-Aryl 1H-Pyrazol-yl Benzene Sulfonamides CHEMOCENTRYX INC (US) 2020-06-25 — — US disclosed
US-20200113898-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASE USING A COMBINATION THERAPY OF SMALL MOLECULE INHIBITORS OF C-C CHEMOKINE RECEPTOR TYPE 9 (CCR9) AND ANTI-ALPHA4BETA7 INTEGRIN BLOCKING ANTIBODIES CHEMOCENTRYX, INC. 2020-04-16 — — US disclosed
US-10596163-B2 Aza-aryl 1H-pyrazol-1-yl benzene sulfonamides CHEMOCENTRYX, INC. (US) 2020-03-24 — — US disclosed
EP-2820006-B1 PYRAZOL-1-YL BENZENE SULFONAMIDES AS CCR9 ANTAGONISTS CHEMOCENTRYX INC (US) 2017-08-02 — — EP disclosed
WO-2016057424-A1 COMBINATION THERAPY OF INHIBITORS OF C-C CHEMOKINE RECEPTOR TYPE 9 (CCR9) AND ANTI-ALHA4BETA7 INTEGRIN BLOCKING ANTIBODIES CHEMOCENTRYX, INC. (US) 2016-04-14 — — WO disclosed
US-20160095921-A1 Combinations and Methods for Treating Inflammatory Bowel Disease Using a Combination Therapy of Small Molecule Inhibitors of C-C Chemokine Receptor 9 (CCR9) and Anti-alpha4beta7 Integrin Blocking Antibodies CHEMOCENTRYX, INC. 2016-04-07 — — US disclosed
US-20150073017-A1 AZA-ARYL 1H-PYRAZOL-1-YL BENZENE SULFONAMIDES CHEMOCENTRYX, INC. 2015-03-12 — — US disclosed
US-8916601-B2 Aza-aryl 1H-pyrazol-1-YL benzene sulfonamides CHEMOCENTRYX, INC. (US) 2014-12-23 — — US disclosed
US-8916601-B2 Aza-aryl 1H-pyrazol-1-YL benzene sulfonamides CHEMOCENTRYX, INC. (US) 2014-12-23 — — US disclosed
WO-2013130811-A1 PYRAZOL-1-YL BENZENE SULFONAMIDES AS CCR9 ANTAGONISTS CHEMOCENTRYX, INC. (US) 2013-09-06 — — WO disclosed
US-20130225580-A1 AZA-ARYL 1H-PYRAZOL-1-YL BENZENE SULFONAMIDES CHEMOCENTRYX, INC. (US) 2013-08-29 — — US disclosed
US-20130225580-A1 AZA-ARYL 1H-PYRAZOL-1-YL BENZENE SULFONAMIDES CHEMOCENTRYX, INC. (US) 2013-08-29 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11045469-B2 Compositions and methods for treating inflammatory bowel disease using a combination therapy of small molecule inhibitors of C-C chemokine receptor type 9 (CCR9) and anti-α4β7 integrin blocking antibodies CCR9, CCR4, ITGB7 POLB 1423/4885ALDH1A1 2337/4885FFAR4 320/4885
US-20210308119-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASE USING CCR9 INHIBITOR AND ANTI-IL-23 BLOCKING ANTIBODIES CCR9, CCR3, CCR1 POLB 2346/4885ALDH1A1 3025/4885FFAR4 1361/4885
US-20130225580-A1 AZA-ARYL 1H-PYRAZOL-1-YL BENZENE SULFONAMIDES CCR9, CCR1, CCR3 POLB 3503/4885ALDH1A1 1144/4885FFAR4 483/4885
US-10596163-B2 Aza-aryl 1H-pyrazol-1-yl benzene sulfonamides CCR9, CCR1, CCR3 POLB 3503/4885ALDH1A1 1144/4885FFAR4 483/4885
US-20200113898-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASE USING A COMBINATION THERAPY OF SMALL MOLECULE INHIBITORS OF C-C CHEMOKINE RECEPTOR TYPE 9 (CCR9) AND ANTI-ALPHA4BETA7 INTEGRIN BLOCKING ANTIBODIES CCR9, ITGB7, CCR4 POLB 1181/4885ALDH1A1 2410/4885FFAR4 329/4885
US-20150073017-A1 AZA-ARYL 1H-PYRAZOL-1-YL BENZENE SULFONAMIDES CCR9, CCR1, CCR3 POLB 3503/4885ALDH1A1 1144/4885FFAR4 483/4885
US-20200197386-A1 Aza-Aryl 1H-Pyrazol-yl Benzene Sulfonamides CCR9, CCR1, CCR3 POLB 3719/4885ALDH1A1 1216/4885FFAR4 449/4885
US-20160095921-A1 Combinations and Methods for Treating Inflammatory Bowel Disease Using a Combination Therapy of Small Molecule Inhibitors of C-C Chemokine Receptor 9 (CCR9) and Anti-alpha4beta7 Integrin Blocking Antibodies CCR9, CCR4, ITGB7 POLB 1173/4885ALDH1A1 2024/4885FFAR4 300/4885
US-11020394-B2 Compositions and methods for treating inflammatory bowel disease using a combination therapy of small molecule inhibitors of C—C chemokine receptor type 9 (CCR9) and anti-α4β7 integrin blocking antibodies CCR9, CCR4, ITGB7 POLB 1427/4885ALDH1A1 2292/4885FFAR4 322/4885
US-20210322410-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASE USING A COMBINATION THERAPY OF SMALL MOLECULE INHIBITORS OF C-C CHEMOKINE RECEPTOR TYPE 9 (CCR9) AND ANTI-ALPHA4BETA7 INTEGRIN BLOCKING ANTIBODIES CCR9, ITGB7, CCR4 POLB 1181/4885ALDH1A1 2410/4885FFAR4 329/4885
US-20200268751-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASE USING A COMBINATION THERAPY OF SMALL MOLECULE INHIBITORS OF C-C CHEMOKINE RECEPTOR TYPE 9 (CCR9) AND ANTI-ALPHA4BETA7 INTEGRIN BLOCKING ANTIBODIES CCR9, ITGB7, CCR4 POLB 1181/4885ALDH1A1 2410/4885FFAR4 329/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback