SCHEMBL248783

SCHEMBL248783

Nc1ccc(S(N)(=O)=O)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 13/20 1.00
CA2 P00918 13/20 1.00
CA9 Q16790 13/20 1.00
CA12 O43570 6/20 1.00
CA4 P22748 5/20 1.00
CA6 P23280 5/20 1.00
CA5A P35218 5/20 1.00
CA7 P43166 5/20 1.00
CA14 Q9ULX7 5/20 1.00
CA5B Q9Y2D0 5/20 1.00
KDM4E B2RXH2 1/20 0.59
MEN1 O00255 1/20 0.59
GAA P10253 1/20 0.59
MAPT P10636 1/20 0.59
PKM P14618 1/20 0.59
RAB9A P51151 1/20 0.59
KMT2A Q03164 1/20 0.59
ALDH1A1 P00352 2/20 0.53
HPGD P15428 2/20 0.53
HSD17B10 Q99714 2/20 0.53

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
SCHEMBL29906360 1.00 CA1 (1.00) CA1CA2CA9CA12CA4
SCHEMBL435704 0.84 CA1 (0.73) CA1CA2CA9CA12CA4
SCHEMBL8496857 0.83 CA1 (0.70) CA1CA2CA9CA12CA4
SCHEMBL1186046 0.83 CA2 (0.70) CA1CA2CA9CA12CA4
SCHEMBL11323509 0.82 CA2 (0.68) CA1CA2CA9CA12CA4
SCHEMBL793608 0.82 CA2 (0.69) CA1CA2CA9CA12CA4
SCHEMBL5737571 0.81 CA1 (0.67) CA1CA2CA9CA12CA4
SCHEMBL11323506 0.81 CA2 (0.67) CA1CA2CA9CA12CA4
SCHEMBL303829 0.81 CA1 (0.68) CA1CA2CA9CA12CA4
SCHEMBL5738131 0.81 CA1 (0.68) CA1CA2CA9CA12CA4

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 130 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240287040-A1 SUBSTITUTED PYRIMIDINYL-PYRAZOLES AS CDK2 INHIBITORS BLUEPRINT MEDICINES CORPORATION 2024-08-29 US disclosed
EP-4355742-A1 SUBSTITUTED PYRIMIDINYL-PYRAZOLES AS CDK2 INHIBITORS Blueprint Medicines Corporation (US) 2024-04-24 EP disclosed
CN-117813300-A Substituted pyrimidinyl-pyrazoles as CDK2 inhibitors 缆图药品公司 2024-04-02 CN disclosed
WO-2022266190-A1 SUBSTITUTED PYRIMIDINYL-PYRAZOLES AS CDK2 INHIBITORS BLUEPRINT MEDICINES CORPORATION (US) 2022-12-22 WO disclosed
US-20180002296-A1 S-TRIAZOLYL ALPHA-MERCAPTO ACETANILIDES AS INHIBITORS OF HIV REVERSE TRANSCRIPTASE ARDEA BIOSCIENCES, INC. 2018-01-04 US disclosed
US-20180002296-A1 S-TRIAZOLYL ALPHA-MERCAPTO ACETANILIDES AS INHIBITORS OF HIV REVERSE TRANSCRIPTASE ARDEA BIOSCIENCES, INC. 2018-01-04 US disclosed
US-9572792-B2 Coumarin compounds as receptor modulators with therapeutic utility ALLERGAN, INC. (US) 2017-02-21 US disclosed
CN-103153993-B Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC. (BS) 2016-06-01 CN disclosed
EP-2594265-B1 Ca ix-specific inhibitors INST VIROLOGY (SK) 2015-10-28 EP disclosed
US-20150265573-A1 COUMARIN COMPOUNDS AS RECEPTOR MODULATORS WITH THERAPEUTIC UTILITY ALLERGAN, INC. 2015-09-24 US disclosed
US-6004948-A NON-STEROIDAL ANTIINFLAMMATORY AGENTS; SIDE EFFECT REDUCTION NYCOMED AUSTRIA GMBH (AT) 1999-12-21 US disclosed
EP-0848703-A1 DERIVATIVES OF BENZOSULPHONAMIDES AS INHIBITORS OF THE ENZYME CYCLO-OXYGENASE II Nycomed Austria GmbH (AT) 1998-06-24 EP disclosed
US-5606063-A NMDA antagonists MERRELL PHARMACEUTICALS INC. (US) 1997-02-25 US disclosed
WO-1997003953-A1 DERIVATIVES OF BENZOSULPHONAMIDES AS INHIBITORS OF THE ENZYME CYCLO-OXYGENASE II NYCOMED AUSTRIA GMBH (AT) 1997-02-06 WO disclosed
EP-0573562-B1 Dihydroquinoline NMDA antagonists MERRELL PHARMA INC (US) 1996-04-24 EP disclosed
EP-0573562-A1 NMDA ANTAGONISTS. MERRELL DOW PHARMA (US) 1993-12-15 EP disclosed
WO-1992015565-A1 NMDA ANTAGONISTS MERRELL DOW PHARMACEUTICALS INC. (US) 1992-09-17 WO disclosed
US-4180503-A FOR DYEING POLYAMIDES BAYER AKTIENGESELLSCHAFT (DE) 1979-12-25 US disclosed
US-4124581-A FOR NATURAL AND SYNTHETIC FIBERS, COLORFAST BAYER AKTIENGESELLSCHAFT (DE) 1978-11-07 US disclosed
US-4060521-A POLYAMIDE BAYER AKTIENGESELLSCHAFT (DT) 1977-11-29 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 (3 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-20240287040-A1 SUBSTITUTED PYRIMIDINYL-PYRAZOLES AS CDK2 INHIBITORS CDK2, CCNI, CDK20 CA1 4212/4885CA2 3059/4885CA9 3304/4885
US-20150265573-A1 COUMARIN COMPOUNDS AS RECEPTOR MODULATORS WITH THERAPEUTIC UTILITY S1PR3, S1PR1, S1PR2 CA1 4396/4885CA2 2566/4885CA9 4646/4885
US-20180002296-A1 S-TRIAZOLYL ALPHA-MERCAPTO ACETANILIDES AS INHIBITORS OF HIV REVERSE TRANSCRIPTASE SPR, POLR2H, TST CA1 2506/4885CA2 849/4885CA9 1284/4885

“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.