SCHEMBL7483264

SCHEMBL7483264

COC(=O)c1cc2nc(C)n(C(=O)OC(C)(C)C)c2cc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
MYC P01106 1/20 0.36
TSHR P16473 2/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA7 P43166 2/20 0.35
CA9 Q16790 2/20 0.35
CA14 Q9ULX7 2/20 0.35
PDK2 Q15119 1/20 0.35
PDK4 Q16654 1/20 0.35
EED O75530 1/20 0.35
RBBP4 Q09028 1/20 0.35
SUZ12 Q15022 1/20 0.35
EZH2 Q15910 1/20 0.35
AEBP2 Q6ZN18 1/20 0.35
NR1H2 P55055 3/20 0.35
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL7475252 0.95 KDM4E (0.38) KDM4EMYCTSHRCA12CA1
SCHEMBL7489186 0.86 NR1H2 (0.36) KDM4ECA12CA9NR1H2GABRG2
SCHEMBL7478753 0.77 EED (0.45) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL7478776 0.76 PIK3R1 (0.32) NR1H2GABRG2GABRB3GABRA5BRD4
SCHEMBL3273621 0.76 KDM4E (0.41) KDM4ECA12CA1CA2CA7
SCHEMBL7480278 0.76 NR1H2 (0.38) KDM4EMYCTSHREEDRBBP4
SCHEMBL7480954 0.76 ESR2 (0.41) NR1H2GABRG2GABRB3GABRA5BRD4
SCHEMBL7479960 0.75 EED (0.45) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL7487767 0.74 TLR9 (0.34) NR1H2GABRG2GABRB3GABRA5BRD4
SCHEMBL862090 0.73 PIK3R1 (0.37) KDM4ENR1H2LMNAGAAGABRG2

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