SCHEMBL10249221

SCHEMBL10249221

COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)O)cc1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.67
ALDH1A1 P00352 1/20 0.67
METAP2 P50579 2/20 0.67
CCR9 P51686 2/20 0.66
LMNA P02545 1/20 0.64
KEAP1 Q14145 1/20 0.64
NFE2L2 Q16236 1/20 0.64

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
SCHEMBL492024 0.88 ACLY (0.81) ACLYALDH1A1METAP2
SCHEMBL27857 0.87 LMNA (0.77) ALDH1A1CCR9LMNA
SCHEMBL14075396 0.87 CYP2C9 (0.73) ALDH1A1METAP2KEAP1NFE2L2
SCHEMBL7322109 0.86 METAP2 (0.73) ALDH1A1METAP2LMNAKEAP1NFE2L2
SCHEMBL9164473 0.85 METAP2 (0.85) ACLYMETAP2CCR9LMNA
SCHEMBL10249599 0.85 GPR27 (0.66) CCR9
SCHEMBL6860504 0.85 SLC10A6 (0.59) ALDH1A1CCR9LMNA
SCHEMBL5110940 0.84 SLC10A6 (0.68) CCR9LMNA
Hydrochloric Acid SCHEMBL7409073 0.84 METAP2 (0.82) ACLYMETAP2CCR9LMNA
SCHEMBL2526816 0.84 LMNA (0.72) ALDH1A1CCR9LMNA

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10364240-B2 Aryl sulfonamides ChemoCentryx. Inc. (US) 2019-07-30 US disclosed
US-9890148-B2 Aryl sulfonamides CHEMOCENTRYX, INC. (US) 2018-02-13 US disclosed
US-20150080351-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. 2015-03-19 US disclosed
US-20150080351-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. 2015-03-19 US disclosed
US-20130267492-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. (US) 2013-10-10 US disclosed
US-20130267492-A1 ARYL SULFONAMIDES CHEMOCENTRYX, INC. (US) 2013-10-10 US disclosed
US-20120014997-A1 ARYL SULFONAMIDES UNGASHE SOLOMON (US) 2012-01-19 US disclosed
US-20120014997-A1 ARYL SULFONAMIDES UNGASHE SOLOMON (US) 2012-01-19 US disclosed
US-20090163498-A1 Aryl Sulfonamides CHEMOCENTRYX, INC. (US) 2009-06-25 US disclosed
US-20090163498-A1 Aryl Sulfonamides CHEMOCENTRYX, INC. (US) 2009-06-25 US disclosed
US-7420055-B2 Antagonists of the chemokine receptor 9 (CCR9); inhibit TECK ligand; antiinflammatory agents and immunoregulators; inflammatory bowel disease; (2-phenylsulfonamidophenyl)-pyridinyl-methanones; N-[4-chloro-2(pyridine4-carbonyl)-phenyl]4-morpholin-4-yl-benzenesulfonamide CHEMOCENTRYX, INC. (US) 2008-09-02 US disclosed
US-7420055-B2 Antagonists of the chemokine receptor 9 (CCR9); inhibit TECK ligand; antiinflammatory agents and immunoregulators; inflammatory bowel disease; (2-phenylsulfonamidophenyl)-pyridinyl-methanones; N-[4-chloro-2(pyridine4-carbonyl)-phenyl]4-morpholin-4-yl-benzenesulfonamide CHEMOCENTRYX, INC. (US) 2008-09-02 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 (5 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-10364240-B2 Aryl sulfonamides CCR9, CCR1, CCR2 ACLY 4188/4885ALDH1A1 1655/4885METAP2 2329/4885
US-20120014997-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 ACLY 4188/4885ALDH1A1 1655/4885METAP2 2329/4885
US-20150080351-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 ACLY 4188/4885ALDH1A1 1655/4885METAP2 2329/4885
US-20090163498-A1 Aryl Sulfonamides CCR9, CCR1, CCR2 ACLY 4188/4885ALDH1A1 1655/4885METAP2 2329/4885
US-20130267492-A1 ARYL SULFONAMIDES CCR9, CCR1, CCR2 ACLY 4188/4885ALDH1A1 1655/4885METAP2 2329/4885

“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.