SCHEMBL5739403

SCHEMBL5739403

O=C(O)CCCCC(=O)C1C2CSC(c3ccccc3)N2C(=O)N1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
EHMT2 Q96KQ7 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
HPGD P15428 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 1/20 0.38
ALOX12 P18054 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GAA P10253 2/20 0.37
HTT P42858 1/20 0.37
ATM Q13315 1/20 0.37
POLB P06746 1/20 0.36

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
SCHEMBL28395791 1.00 CYP2C9 (0.40) CYP2C9CYP2C19EHMT2MEN1KMT2A
SCHEMBL9678848 1.00 CYP2C9 (0.40) CYP2C9CYP2C19EHMT2MEN1KMT2A
SCHEMBL9680323 1.00 CYP2C9 (0.40) CYP2C9CYP2C19EHMT2MEN1KMT2A
SCHEMBL9845295 0.89 MEN1 (0.42) CYP2C9CYP2C19EHMT2MEN1KMT2A
SCHEMBL28390865 0.89 MEN1 (0.44) CYP2C9CYP2C19MEN1KMT2AHPGD
SCHEMBL9032586 0.89 MEN1 (0.42) CYP2C9CYP2C19EHMT2MEN1KMT2A
SCHEMBL9737464 0.85 CYP2C9 (0.46) CYP2C9CYP2C19EHMT2MEN1KMT2A
SCHEMBL30480079 0.85 CYP2C9 (0.46) CYP2C9CYP2C19EHMT2MEN1KMT2A
SCHEMBL9737057 0.85 CYP2C9 (0.46) CYP2C9CYP2C19EHMT2MEN1KMT2A
SCHEMBL9679709 0.82 TOP1 (0.39) CYP2C9CYP2C19EHMT2MEN1KMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5208981-A None JP disclosed
EP-1219625-B1 Novel substituted 2-(6-benzyl-5-oxo-3-phenyl-(S3,7S,7AR)- perhydroimidazol (1,5-C) (1,3) thiazol-7YL) compounds COUNCIL SCIENT IND RES (IN) 2006-05-17 EP disclosed
EP-1219625-A1 Novel substituted 2-(6-benzyl-5-oxo-3-phenyl-(S3,7S,7AR)- pherhydroimidazol (1,5-C) (1,3) thiazol-7YL) compounds Council of Scientific and Industrial Research (IN) 2002-07-03 EP disclosed
EP-0513700-B1 Process for the preparation of imidazothiazolone derivates MERCK PATENT GMBH (DE) 1997-07-23 EP disclosed
JP-H05208981-A PREPARATION OF IMIDAZOTHIAZOLONE DERIVATIVE MERCK PATENT GMBH 1993-08-20 JP disclosed
US-5233045-A PROCESS FOR THE PREPARATION OF IMIDAZOTHIAZOLONE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-08-03 US disclosed
EP-0513700-A1 Process for the preparation of imidazothiazolone derivates MERCK PATENT GmbH (DE) 1992-11-19 EP disclosed