SCHEMBL2773751

SCHEMBL2773751

CCc1c(C(=O)O)oc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 4/20 0.58
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
TSHR P16473 1/20 0.55
APEX1 P27695 1/20 0.55
MAPK1 P28482 1/20 0.53
PLK1 P53350 1/20 0.52
BCL2 P10415 1/20 0.52
BCL2L1 Q07817 1/20 0.52
BAD Q92934 1/20 0.52
KDM4E B2RXH2 2/20 0.48
AHR P35869 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
NPY1R P25929 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 2/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL4672803 0.91 MCL1 (0.54) MCL1KMT2AMEN1TSHRAPEX1
SCHEMBL5273001 0.89 CAPN1 (0.56) MCL1KMT2AMEN1TSHRAPEX1
SCHEMBL4093872 0.86 PLK1 (0.52) MCL1TSHRMAPK1PLK1KDM4E
SCHEMBL13348987 0.85 PLK1 (0.51) MCL1KMT2AMEN1TSHRPLK1
SCHEMBL28131940 0.85 TEAD1 (0.51) KMT2AMEN1TSHRPLK1KDM4E
SCHEMBL27556248 0.84 MCL1 (0.60) MCL1KMT2AMEN1TSHRAPEX1
SCHEMBL4672754 0.84 MCL1 (0.65) MCL1KMT2AMEN1TSHRAPEX1
Oxalic Acid SCHEMBL28849573 0.84 ALDH1A1 (0.49) MCL1KMT2AMEN1TSHRPLK1
SCHEMBL9393930 0.83 PLK1 (0.64) MCL1KMT2AMEN1TSHRAPEX1
SCHEMBL1443853 0.83 MCL1 (0.58) MCL1KMT2AMEN1TSHRAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050256104-A1 substituted 1,1,4-1l6-trioxo[1,2]thiazepan-4-ylamide-derived protease inhibitors which inhibit the likes of cathepsin K; treating osteoporosis, osteo- and rheumatoid arthritis and periodontal disease; inhibiting excessive cartilage or matrix degradation SMITHKLINE BEECHAM CORPORATION 2005-11-17 US claimed
US-20040002487-A1 Protease inhibitors MARQUIS ROBERT WELLS (US) 2004-01-01 US claimed
US-20030225061-A1 Protease inhibitors MARQUIS ROBERT WELLS (US) 2003-12-04 US claimed
CN-1444481-A Protease inhibitors SMITHKLINE BEECHAM CORP (US) 2003-09-24 CN claimed
US-20030144175-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2003-07-31 US claimed
US-20030044399-A1 Method of treatment SMITHKLINE BEECHAM CORPORATION 2003-03-06 US claimed
US-20020147188-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2002-10-10 US claimed
US-20240383856-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2024-11-21 US disclosed
US-20240376055-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2024-11-14 US disclosed
US-20240317708-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2024-09-26 US disclosed
EP-4192812-B1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2024-09-04 EP disclosed
US-20240270715-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2024-08-15 US disclosed
EP-4192813-B1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2024-08-14 EP disclosed
WO-2001095911-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-12-20 WO disclosed
EP-0231244-A1 6-ALKYLIDENE PENEMS BEECHAM GROUP PLC (GB) 1987-08-12 EP disclosed
WO-1987000525-A1 6-ALKYLIDENE PENEMS BEECHAM GROUP P.L.C. (GB) 1987-01-29 WO disclosed
US-4495357-A THROMBOXANE A2 SYNTHETASE INHIBITORS THE UPJOHN COMPANY (US) 1985-01-22 US disclosed
US-4455427-A THROMBOXANE INHIBITORS THE UPJOHN COMPANY (US) 1984-06-19 US disclosed
US-4452986-A THROMBOXANE A2 SYNTHETASE INHIBITORS THE UPJOHN COMPANY (US) 1984-06-05 US disclosed
EP-0069521-A2 Pyridinyl and imidazolyl derivatives of benzofurans and benzothiophenes THE UPJOHN COMPANY (US) 1983-01-12 EP 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 (10 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-20030225061-A1 Protease inhibitors CTSK, MMP13, CTSZ MCL1 2488/4885KMT2A 2920/4885MEN1 2054/4885
US-20030044399-A1 Method of treatment DNPEP, PEPD, ANPEP MCL1 2692/4885KMT2A 1833/4885MEN1 3024/4885
US-20240383856-A1 INHIBITORS OF TRANSGLUTAMINASES TGM2, TGM3, TGM1 MCL1 4778/4885KMT2A 988/4885MEN1 590/4885
US-20240376055-A1 INHIBITORS OF TRANSGLUTAMINASES TGM2, TGM3, TGM1 MCL1 4778/4885KMT2A 988/4885MEN1 590/4885
US-20240317708-A1 INHIBITORS OF TRANSGLUTAMINASES TGM2, TGM3, TGM1 MCL1 4778/4885KMT2A 988/4885MEN1 590/4885
US-20050256104-A1 substituted 1,1,4-1l6-trioxo[1,2]thiazepan-4-ylamide-derived protease inhibitors which inhibit the likes of cathepsin K; treating osteoporosis, osteo- and rheumatoid arthritis and periodontal disease; inhibiting excessive cartilage or matrix degradation CTSK, CTSZ, CTSE MCL1 2522/4885KMT2A 2410/4885MEN1 3396/4885
US-20020147188-A1 Protease inhibitors CTSK, MMP13, CTSZ MCL1 2488/4885KMT2A 2920/4885MEN1 2054/4885
US-20040002487-A1 Protease inhibitors CTSK, MMP13, CTSZ MCL1 2488/4885KMT2A 2920/4885MEN1 2054/4885
US-20240270715-A1 INHIBITORS OF TRANSGLUTAMINASES TGM2, TGM3, TGM1 MCL1 4778/4885KMT2A 988/4885MEN1 590/4885
US-20030144175-A1 Protease inhibitors CTSK, MMP13, CTSZ MCL1 2488/4885KMT2A 2920/4885MEN1 2054/4885

“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.