SCHEMBL7475671

SCHEMBL7475671

COC(=O)c1cc2[nH]c(C)nc2cc1OC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 2/20 0.48
PDE4B Q07343 3/20 0.44
PDE4A P27815 2/20 0.44
PDE4C Q08493 2/20 0.44
PDE4D Q08499 2/20 0.44
TOP2A P11388 1/20 0.44
EED O75530 1/20 0.43
RBBP4 Q09028 1/20 0.43
SUZ12 Q15022 1/20 0.43
EZH2 Q15910 1/20 0.43
AEBP2 Q6ZN18 1/20 0.43
GPR119 Q8TDV5 2/20 0.43
PARP1 P09874 2/20 0.41
NSD2 O96028 1/20 0.41
NPBWR1 P48145 1/20 0.41
MCHR1 Q99705 1/20 0.41
PIK3CD O00329 2/20 0.40
PIK3CA P42336 2/20 0.40
PIK3CB P42338 2/20 0.40
PIK3CG P48736 2/20 0.40

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
SCHEMBL7475661 0.96 CHEK2 (0.48) CHEK2PDE4BPDE4APDE4CPDE4D
SCHEMBL7484145 0.86 CHEK2 (0.49) CHEK2PDE4BPDE4APDE4CPDE4D
SCHEMBL7484137 0.84 CHEK2 (0.49) CHEK2PDE4BPDE4APDE4CPDE4D
SCHEMBL7484248 0.83 CHEK2 (0.46) CHEK2PDE4BPDE4APDE4CPDE4D
SCHEMBL7484268 0.82 CHEK2 (0.45) CHEK2PDE4BPDE4APDE4CPDE4D
SCHEMBL7479960 0.82 EED (0.45) CHEK2PDE4BPDE4APDE4CPDE4D
SCHEMBL7484260 0.82 CHEK2 (0.45) CHEK2PDE4BPDE4APDE4CPDE4D
SCHEMBL7484242 0.81 CHEK2 (0.46) CHEK2PDE4BPDE4APDE4CPDE4D
SCHEMBL7478753 0.80 EED (0.45) CHEK2PDE4BPDE4APDE4CPDE4D
SCHEMBL5970662 0.78 PDE4B (0.45) PDE4BPDE4APDE4CPDE4DTOP2A

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