SCHEMBL211498

SCHEMBL211498

COc1cccc(CC(=O)Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTBP2 P56545 1/20 0.60
ALDH1A1 P00352 1/20 0.56
HTT P42858 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CYP1A2 P05177 1/20 0.54
MMP13 P45452 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
POLB P06746 1/20 0.52
IDO1 P14902 2/20 0.51
AGXT P21549 2/20 0.51
TAAR1 Q96RJ0 1/20 0.51
CMA1 P23946 1/20 0.51
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
USP2 O75604 1/20 0.51
RAB9A P51151 1/20 0.51
SIGMAR1 Q99720 1/20 0.51

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
SCHEMBL4071390 0.85 CTBP2 (0.64) CTBP2ALDH1A1HTTSMN1; SMN2CYP1A2
SCHEMBL15513856 0.84 CTBP2 (0.62) CTBP2ALDH1A1HTTSMN1; SMN2CYP1A2
SCHEMBL269177 0.84 CTBP2 (0.62) CTBP2ALDH1A1HTTSMN1; SMN2CYP1A2
SCHEMBL229067 0.84 PTGS1 (0.67) CTBP2ALDH1A1HTTSMN1; SMN2CYP1A2
SCHEMBL7898755 0.84 FAAH (0.46) CTBP2ALDH1A1HTTSMN1; SMN2POLB
SCHEMBL29824310 0.84 PTGS1 (0.67) CTBP2ALDH1A1HTTSMN1; SMN2CYP1A2
SCHEMBL7956017 0.83 P2RX3 (0.48) CTBP2ALDH1A1HTTSMN1; SMN2MEN1
SCHEMBL3257076 0.83 HDAC1 (0.57) ALDH1A1HTTSMN1; SMN2TAAR1MTNR1A
SCHEMBL5394435 0.83 CYP3A4 (0.54) CTBP2ALDH1A1MEN1KMT2A
SCHEMBL3005839 0.83 ALDH1A1 (0.61) CTBP2ALDH1A1HTTSMN1; SMN2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117510429-A Compound containing methyl isoxazole structure, and preparation method and application thereof 中国农业大学 2024-02-06 CN claimed
CN-113233964-A Synthesis method of 5-methoxy-2-tetralone 武汉工程大学 2021-08-10 CN claimed
CN-107011227-B Nitrine based on tubulin-beta-lactam Small-molecule probe and its preparation method and application 郑州大学 2019-08-09 CN claimed
CN-107011227-A Nitrine beta-lactam Small-molecule probe based on tubulin and its preparation method and application 郑州大学 2017-08-04 CN claimed
EP-1506176-B1 AMINOINDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PFIZER ITALIA SRL (IT) 2013-04-24 EP claimed
EP-1556417-B1 RACEMOSELECTIVE PREPARATION OF BRIDGED METALLOCENE COMPLEXES HAVING UNSUBSTITUTED OR 2-SUBSTITUTED INDENYL LIGANDS BASELL POLYOLEFINE GMBH (DE) 2009-06-10 EP claimed
US-7358381-B2 Racemoselective preparation of bridged metallocene complexes having unsubstituted or 2-substituted indenyl ligands BASELL POLYOLEFINE GMBH (DE) 2008-04-15 US claimed
CN-1271057-C Method for preparing 1-methyl-3-ethyl-3-(3-hydroxy phenyl)-hexa hydrogen-1 H azepin hydrochloride UNIV FUDAN (CN) 2006-08-23 CN claimed
EP-1554297-B1 RACEMOSELECTIVE SYNTHESIS OF RAC-DIORGANOSILYLBIS(2-METHYLBENZO¬E|INDEYL) ZIRCONIUM COMPONDS BASELL POLYOLEFINE GMBH (DE) 2006-07-12 EP claimed
US-20060111527-A1 Racemoselective preparation of bridged metallocene complexes having unsubstituted or 2-substituted indenyl ligands EQUISTAR CHEMICALS, LP 2006-05-25 US claimed
EP-1556417-A2 RACEMOSELECTIVE PREPARATION OF BRIDGED METALLOCENE COMPLEXES HAVING UNSUBSTITUTED OR 2-SUBSTITUTED INDENYL LIGANDS Basell Polyolefine GmbH (DE) 2005-07-27 EP claimed
EP-1554297-A1 RACEMOSELECTIVE SYNTHESIS OF RAC-DIORGANOSILYLBIS(2-METHYLBENZO[E]INDEYL) ZIRCONIUM COMPONDS Basell Polyolefine GmbH (DE) 2005-07-20 EP claimed
WO-2004037834-A2 RACEMOSELECTIVE PREPARATION OF BRIDGED METALLOCENE COMPLEXES HAVING UNSUBSTITUTED OR 2-SUBSTITUTED INDENYL LIGANDS BASELL POLYOLEFINE GMBH (DE) 2004-05-06 WO claimed
WO-2004037840-A1 RACEMOSELECTIVE SYNTHESIS OF RAC-DIORGANOSILYLBIS(2-METHYLBENZO[E]INDEYL) ZIRCONIUM COMPONDS BASELL POLYOLEFINE GMBH (DE) 2004-05-06 WO claimed
EP-4731630-A1 HOMOPHTHALAZINONE INDOLE PARP INHIBITORS AND METHODS OF USE Valo Health, Inc. (US) 2026-04-29 EP disclosed
US-20250346616-A1 ROCK INHIBITORS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2025-11-13 US disclosed
US-12435060-B2 Acylamino bridged heterocyclic compound, and composition and application thereof BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2025-10-07 US disclosed
US-3994888-A Cephalosporin cleavage process ELI LILLY AND COMPANY (US) 1976-11-30 US disclosed
US-3965093-A 6-Arylthio penicillanic acid and derivatives thereof E. R. SQUIBB & SONS, INC. (US) 1976-06-22 US disclosed
US-3954744-A ANTIBACTERIAL E. R. SQUIBB & SONS, INC. (US) 1976-05-04 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-20250346616-A1 ROCK INHIBITORS AND USES THEREOF ROCK1, ROCK2, RHOA CTBP2 3331/4885ALDH1A1 2229/4885HTT 3843/4885
US-20060111527-A1 Racemoselective preparation of bridged metallocene complexes having unsubstituted or 2-substituted indenyl ligands ITPA, IMPA1, INTS9 CTBP2 1074/4885ALDH1A1 888/4885HTT 4513/4885
US-12435060-B2 Acylamino bridged heterocyclic compound, and composition and application thereof RIPK1, RIPK3, RIPK4 CTBP2 2846/4885ALDH1A1 4164/4885HTT 1088/4885

“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.