SCHEMBL1017792

SCHEMBL1017792

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.54
ALDH1A1 P00352 5/20 0.54
HSD17B10 Q99714 3/20 0.54
MAPT P10636 3/20 0.54
CASP1 P29466 2/20 0.54
HPGD P15428 2/20 0.54
ATM Q13315 2/20 0.54
GLA P06280 1/20 0.54
GAA P10253 1/20 0.54
CASP7 P55210 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.53
TSHR P16473 2/20 0.53
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
XDH P47989 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
FLT1 P17948 1/20 0.49

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
SCHEMBL69263 0.89 KDM4E (0.62) KDM4EALDH1A1HSD17B10MAPTCASP1
SCHEMBL6238741 0.86 ALDH1A1 (0.54) KDM4EALDH1A1HSD17B10MAPTCASP1
SCHEMBL2496347 0.86 ALDH1A1 (0.57) KDM4EALDH1A1HSD17B10MAPTCASP1
SCHEMBL1483403 0.86 TSHR (0.55) KDM4EALDH1A1HSD17B10MAPTCASP1
SCHEMBL29606273 0.86 TSHR (0.55) KDM4EALDH1A1HSD17B10MAPTCASP1
SCHEMBL1929461 0.86 ALDH1A1 (0.61) KDM4EALDH1A1HSD17B10MAPTCASP1
SCHEMBL27531018 0.84 ALDH1A1 (0.53) KDM4EALDH1A1HSD17B10MAPTCASP1
SCHEMBL22927642 0.83 TSHR (0.55) KDM4EALDH1A1HSD17B10MAPTCASP1
SCHEMBL10400378 0.83 KDM4E (0.59) KDM4EALDH1A1HSD17B10MAPTCASP1
SCHEMBL27460286 0.82 SMN1; SMN2 (0.53) ALDH1A1HSD17B10MAPTCASP1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117127400-A Mite-removing and moisture-absorbing fabric and preparation method thereof 薛桂芹 2023-11-28 CN claimed
EP-3233842-B1 BICYCLOHETEROARYL-HETEROARYL-BENZOIC ACID COMPOUNDS AS RETINOIC ACID RECEPTOR BETA (RARB) AGONISTS KING S COLLEGE LONDON (GB) 2025-03-26 EP disclosed
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2024-04-11 US disclosed
CN-117127400-A Mite-removing and moisture-absorbing fabric and preparation method thereof 薛桂芹 2023-11-28 CN disclosed
CN-117127400-A Mite-removing and moisture-absorbing fabric and preparation method thereof 薛桂芹 2023-11-28 CN disclosed
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2023-08-24 US disclosed
US-11401265-B2 Bicycloheteroaryl-heteroaryl-benzoic acid compounds as retinoic acid receptor beta (RARβ) agonists KING'S COLLEGE LONDON 2022-08-02 US disclosed
US-20210130337-A1 Bicycloheteroaryl-Heteroaryl-Benzoic Acid Compounds as Retinoic Acid Receptor Beta (RARBeta) Agonists KING'S COLLEGE LONDON (GB) 2021-05-06 US disclosed
US-20210130337-A1 Bicycloheteroaryl-Heteroaryl-Benzoic Acid Compounds as Retinoic Acid Receptor Beta (RARBeta) Agonists KING'S COLLEGE LONDON (GB) 2021-05-06 US disclosed
US-20210070707-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2021-03-11 US disclosed
CN-101072755-A Pyridyl inhibitors of Hedgehog signaling GENENTECH INC (US) 2007-11-14 CN disclosed
EP-1789390-A2 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING Genentech, Inc. (US) 2007-05-30 EP disclosed
US-20060063779-A1 Pyridyl inhibitors of hedgehog signalling CURIS ROYALTY LLC 2006-03-23 US disclosed
WO-2006028958-A2 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2006-03-16 WO disclosed
US-20020115692-A1 Tryptophan derivatives CELLTECH R&D, LTD. (GB) 2002-08-22 US disclosed
WO-2002042294-A1 1-SULFONYL SUBSTITUTED TRYPTOPHANE DERIVATIVES AND ITS USE AS INTEGRIN INHIBITORS CELLTECH R & D LIMITED (GB) 2002-05-30 WO disclosed
EP-1121342-A1 DIAMINOPROPIONIC ACID DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2001-08-08 EP disclosed
WO-2000021920-A1 DIAMINOPROPIONIC ACID DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-04-20 WO disclosed
EP-0314126-A2 Process and intermediates for the preparation of halogenated protease inhibitors G.D. Searle & Co. (US) 1989-05-03 EP disclosed
US-4803294-A Process and intermediates for the preparation of halogenated protease inhibitors G. D. SEARLE & CO. (US) 1989-02-07 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 (7 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-20210130337-A1 Bicycloheteroaryl-Heteroaryl-Benzoic Acid Compounds as Retinoic Acid Receptor Beta (RARBeta) Agonists RARB, RARA, RXRB KDM4E 3575/4885ALDH1A1 253/4885HSD17B10 674/4885
US-11401265-B2 Bicycloheteroaryl-heteroaryl-benzoic acid compounds as retinoic acid receptor beta (RARβ) agonists RARB, RARA, RXRB KDM4E 3621/4885ALDH1A1 238/4885HSD17B10 700/4885
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO KDM4E 411/4885ALDH1A1 2407/4885HSD17B10 4521/4885
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING SHH, GLI1, SMO KDM4E 382/4885ALDH1A1 2371/4885HSD17B10 4504/4885
US-20210070707-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO KDM4E 411/4885ALDH1A1 2407/4885HSD17B10 4521/4885
US-20020115692-A1 Tryptophan derivatives IDO1, TPH1, IDO2 KDM4E 3104/4885ALDH1A1 103/4885HSD17B10 1882/4885
US-20060063779-A1 Pyridyl inhibitors of hedgehog signalling SHH, GLI1, SMO KDM4E 411/4885ALDH1A1 2407/4885HSD17B10 4521/4885

“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.