SCHEMBL1017989

SCHEMBL1017989

NS(=O)(=O)c1ccc(C(=O)O)c(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.56
CA1 P00915 12/20 0.56
CA9 Q16790 6/20 0.56
CA5A P35218 4/20 0.56
CA7 P43166 4/20 0.56
CA5B Q9Y2D0 4/20 0.56
CA12 O43570 3/20 0.56
CA6 P23280 3/20 0.56
CA14 Q9ULX7 3/20 0.56
CA4 P22748 2/20 0.56
CA3 P07451 2/20 0.56
CA13 Q8N1Q1 1/20 0.56
CISD1 Q9NZ45 1/20 0.56
TSHR P16473 1/20 0.55
CASP1 P29466 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
LMNA P02545 1/20 0.50
CYP2C19 P33261 1/20 0.50
PYGL P06737 1/20 0.49
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL1185864 0.85 LMNA (0.69) CA2CA1CA9CA5ACA7
SCHEMBL2807663 0.85 TSHR (0.59) CA2CA1CA9CA5ACA7
SCHEMBL27878677 0.84 LMNA (0.67) CA2CA1CA9CA5ACA7
SCHEMBL9516048 0.83 TSHR (0.57) CA2CA1CA9CA5ACA7
SCHEMBL7527853 0.83 ALDH1A1 (0.58) CA2CA1CA9CA5ACA7
SCHEMBL7824801 0.82 CA2 (0.55) CA2CA1CA9CA5ACA7
SCHEMBL18577911 0.81 TSHR (0.55) CA2CA1CA9CA5ACA7
SCHEMBL403618 0.81 LMNA (0.74) TSHRCASP1SMN1; SMN2LMNACYP2C19
SCHEMBL27530309 0.81 ALDH1A1 (0.57) CA2CA1CA9CA5ACA7
Hydrochloric Acid SCHEMBL9651756 0.80 LMNA (0.72) TSHRCASP1SMN1; SMN2LMNACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12467928-B2 N-terminal modifier agents and binders for treating and analyzing peptides DF PEPTIDE ACQUISITION LLC 2025-11-11 US disclosed
US-20240377408-A1 N-TERMINAL MODIFIER AGENTS AND BINDERS FOR TREATING AND ANALYZING PEPTIDES DF PEPTIDE ACQUISITION LLC 2024-11-14 US disclosed
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2024-04-11 US disclosed
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2023-08-24 US disclosed
US-20220283175-A1 METALLOENZYMES FOR BIOMOLECULAR RECOGNITION OF N-TERMINAL MODIFIED PEPTIDES Encodia, Inc. (US) 2022-09-08 US disclosed
US-20220283175-A1 METALLOENZYMES FOR BIOMOLECULAR RECOGNITION OF N-TERMINAL MODIFIED PEPTIDES Encodia, Inc. (US) 2022-09-08 US disclosed
US-20210070707-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2021-03-11 US disclosed
US-20200190030-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2020-06-18 US disclosed
US-10647719-B2 Bicyclic compounds as dual ATX/CA inhibitors HOFFMANN-LA ROCHE INC. (US) 2020-05-12 US disclosed
US-20180258043-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2018-09-13 US disclosed
US-20050288267-A1 Estradiol prodrugs BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2005-12-29 US disclosed
US-20050282793-A1 Steroid prodrugs with androgenic action BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2005-12-22 US disclosed
US-20050277625-A1 Estriol and estetrol prodrugs BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2005-12-15 US disclosed
WO-2005113574-A1 AMINOSULPHONYL- OR AMINOSULPHONYLAMINO-SUBSTITUTED PHENYL ESTERS AS ESTRADIOL PRODRUGS SCHERING AKTIENGESELLSCHAFT (DE) 2005-12-01 WO disclosed
WO-2005113575-A1 STEROID PRODRUGS WITH ANDROGENIC EFFECT SCHERING AKTIENGESELLSCHAFT (DE) 2005-12-01 WO disclosed
WO-2005113576-A1 AMINOSULPHONYL- OR AMINOSULPHONYLAMINO-SUBSTITUTED PHENYL ESTERS AS ESTRIOL AND ESTETROL PRODRUGS SCHERING AKTIENGESELLSCHAFT (DE) 2005-12-01 WO disclosed
EP-1569646-A2 PIPERIDINE DERIVATIVES AS CCR5 ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2005-09-07 EP disclosed
EP-1569647-A2 CYCLOHEXYL COMPOUNDS AS CCR5 ANTAGONISTS SmithKline Beecham Corporation (US) 2005-09-07 EP disclosed
WO-2004054581-A2 CYCLOHEXYL COMPOUNDS AS CCR5 ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2004-07-01 WO disclosed
WO-2004054974-A2 PIPERIDINE DERIVATIVES AS CCR5 ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2004-07-01 WO 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 (9 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-20200190030-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO CA2 3856/4885CA1 4396/4885CA9 3829/4885
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO CA2 3856/4885CA1 4396/4885CA9 3829/4885
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING SHH, GLI1, SMO CA2 3954/4885CA1 4482/4885CA9 3896/4885
US-20210070707-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO CA2 3856/4885CA1 4396/4885CA9 3829/4885
US-20050288267-A1 Estradiol prodrugs CYP19A1, ESR1, HSD17B11 CA2 2551/4885CA1 2303/4885CA9 1880/4885
US-20050282793-A1 Steroid prodrugs with androgenic action CYP21A2, CYP17A1, NR5A1 CA2 2329/4885CA1 1614/4885CA9 575/4885
US-20050277625-A1 Estriol and estetrol prodrugs HSD17B11, CYP19A1, ESR1 CA2 3004/4885CA1 1643/4885CA9 2241/4885
US-20180258043-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO CA2 3856/4885CA1 4396/4885CA9 3829/4885
US-10647719-B2 Bicyclic compounds as dual ATX/CA inhibitors ATXN2, ATXN2L, ATXN10 CA2 238/4885CA1 1155/4885CA9 1224/4885

“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.