SCHEMBL7479960

SCHEMBL7479960

COC(=O)c1cc2c(cc1OC1CCN(C(=O)OC(C)(C)C)CC1)nc(C)n2C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EED O75530 1/20 0.45
RBBP4 Q09028 1/20 0.45
SUZ12 Q15022 1/20 0.45
EZH2 Q15910 1/20 0.45
AEBP2 Q6ZN18 1/20 0.45
PDE4B Q07343 3/20 0.44
PDE4D Q08499 3/20 0.44
PDE4A P27815 2/20 0.44
PDE4C Q08493 2/20 0.44
GPR119 Q8TDV5 6/20 0.42
CHEK2 O96017 1/20 0.42
TOP2A P11388 1/20 0.41
NSD2 O96028 1/20 0.41
NPBWR1 P48145 1/20 0.40
MCHR1 Q99705 1/20 0.40
PIK3CD O00329 2/20 0.39
PIK3CA P42336 2/20 0.39
PIK3CB P42338 2/20 0.39
PIK3CG P48736 2/20 0.39
KDM1A O60341 1/20 0.39

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
SCHEMBL7478753 0.96 EED (0.45) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL7477789 0.82 PDE4D (0.43) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL7485838 0.82 PDE4D (0.43) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL7475671 0.82 CHEK2 (0.48) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL7475661 0.80 CHEK2 (0.48) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL7486430 0.79 CHEK2 (0.53) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL7475252 0.77 KDM4E (0.38) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL7488290 0.77 TBK1 (0.40) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL3157416 0.76 PDE4B (0.52) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL5970662 0.75 PDE4B (0.45) EEDRBBP4SUZ12EZH2AEBP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0865281-B1 NAPHTHYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES AS ANTICOAGULANTS BERLEX LAB (US) 2002-04-03 EP disclosed
US-5849759-A Naphthyl-substituted benzimidazole derivatives as anti-coagulants BERLEX LABORATORIES, INC. (US) 1998-12-15 US disclosed