SCHEMBL484748

SCHEMBL484748

COC(=O)c1ccc2c(c1)C(=O)CC2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.51
MAPK14 Q16539 2/20 0.49
ALDH1A1 P00352 3/20 0.49
ATM Q13315 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
SRD5A1 P18405 1/20 0.48
SRD5A2 P31213 1/20 0.48
CASP3 P42574 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
XDH P47989 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
PTPRC P08575 1/20 0.45
CRBN Q96SW2 1/20 0.44
MAPT P10636 2/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL2258053 0.90 ALDH1A1 (0.50) MAPK14ALDH1A1ATMSMN1; SMN2NPSR1
SCHEMBL29446230 0.90 SMN1; SMN2 (0.50) MAPK14ALDH1A1ATMSMN1; SMN2NPSR1
SCHEMBL354166 0.90 SMN1; SMN2 (0.50) MAPK14ALDH1A1ATMSMN1; SMN2NPSR1
SCHEMBL31532073 0.87 SRD5A1 (0.51) MAPK14ALDH1A1ATMSMN1; SMN2NPSR1
SCHEMBL883773 0.87 SRD5A1 (0.51) MAPK14ALDH1A1ATMSMN1; SMN2NPSR1
SCHEMBL31337617 0.83 BRD4 (0.55) PBRM1MAPK14ALDH1A1SMN1; SMN2SRD5A1
SCHEMBL30583381 0.83 BRD4 (0.55) PBRM1MAPK14ALDH1A1SMN1; SMN2SRD5A1
SCHEMBL10502958 0.82 ALOX15 (0.45) PBRM1MAPK14ALDH1A1ATMSMN1; SMN2
SCHEMBL9372469 0.81 MAPK14 (0.57) MAPK14ALDH1A1SMN1; SMN2SRD5A1SRD5A2
SCHEMBL12365119 0.81 MAPK14 (0.50) MAPK14ALDH1A1ATMSMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112274046-B Antibacterial towel rack and preparation process thereof 温州欧迪家居用品有限公司 2022-07-22 CN claimed
CN-112274046-A Antibacterial towel rack and preparation process thereof 温州欧迪家居用品有限公司 2021-01-29 CN claimed
CN-114907389-A Boronic acid derivatives 首药控股(北京)股份有限公司 2022-08-16 CN disclosed
CN-112274046-B Antibacterial towel rack and preparation process thereof 温州欧迪家居用品有限公司 2022-07-22 CN disclosed
US-20220135539-A1 BIARYL AMIDE COMPOUNDS, PREPARATION METHODS AND MEDICAL APPLICATIONS THEREOF Eternity Bioscience Inc. 2022-05-05 US disclosed
EP-2962992-B1 FULLERENE DERIVATIVE, ORGANIC SOLAR CELL USING SAME, AND MANUFACTURING METHOD THEREOF LG CHEMICAL LTD (KR) 2021-07-07 EP disclosed
CN-112274046-A Antibacterial towel rack and preparation process thereof 温州欧迪家居用品有限公司 2021-01-29 CN disclosed
EP-2704571-B1 AMINO-PYRIDINE-CONTAINING SPLEEN TYROSINE KINASE (SYK) INHIBITORS MERCK SHARP & DOHME (US) 2020-04-22 EP disclosed
EP-2704571-B1 AMINO-PYRIDINE-CONTAINING SPLEEN TYROSINE KINASE (SYK) INHIBITORS MERCK SHARP & DOHME (US) 2020-04-22 EP disclosed
US-9522882-B2 Strigolactam derivatives as plant growth regulating compounds SYNGENTA PARTICIPATIONS AG (CH) 2016-12-20 US disclosed
US-9522882-B2 Strigolactam derivatives as plant growth regulating compounds SYNGENTA PARTICIPATIONS AG (CH) 2016-12-20 US disclosed
US-20100249095-A1 Substituted Spiro-amide Compounds GRUENENTHAL GMBH (DE) 2010-09-30 US disclosed
US-20100249095-A1 Substituted Spiro-amide Compounds GRUENENTHAL GMBH (DE) 2010-09-30 US disclosed
US-20100249095-A1 Substituted Spiro-amide Compounds GRUENENTHAL GMBH (DE) 2010-09-30 US disclosed
WO-2010108651-A1 SUBSTITUTED SPIRO-AMIDE COMPOUNDS Grünenthal GmbH (DE) 2010-09-30 WO disclosed
EP-0657426-B1 Tricyclic pyrrole derivatives HOFFMANN LA ROCHE (CH) 1998-07-22 EP disclosed
US-5646173-A ANTISEROTONINE AGENTS; CENTRAL NERVOUS SYSTEM DISORDERS; ANTIDEPRESSANTS HOFFMANN-LA ROCHE INC. (US) 1997-07-08 US disclosed
US-5525617-A ANTICOAGULANT MERCK & CO., INC. (US) 1996-06-11 US disclosed
WO-1996015099-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1996-05-23 WO disclosed
EP-0657426-A2 Tricyclic pyrrole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1995-06-14 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 (2 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-20220135539-A1 BIARYL AMIDE COMPOUNDS, PREPARATION METHODS AND MEDICAL APPLICATIONS THEREOF BRAF, NRAS, RAF1 PBRM1 386/4885MAPK14 1089/4885ALDH1A1 1618/4885
US-20100249095-A1 Substituted Spiro-amide Compounds BDKRB1, BDKRB2, REN PBRM1 916/4885MAPK14 2645/4885ALDH1A1 2086/4885

“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.