SCHEMBL6016959

CCOC(=O)OC(C)OC(=O)c1ccc2c(c1)nc(C(=O)NC1CCN(C(C)C)CC1)n2CC(=O)Nc1ccc(Cl)cn1.CCOC(=O)OC(C)OC(=O)c1ccc2nc[nH]c2c1

nearest known ligand 0.49

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	F10	P00742	15/20	0.49

▸	F2	P00734	2/20	0.49

▸	TDP1	Q9NUW8	1/20	0.36

▸	NPC1	O15118	2/20	0.35

▸	LMNA	P02545	1/20	0.35

▸	USP2	O75604	1/20	0.35

▸	ALDH1A1	P00352	1/20	0.35

▸	RAB9A	P51151	1/20	0.35

▸	SMYD3	Q9H7B4	1/20	0.34

▸	POLB	P06746	1/20	0.34

▸	CASP3	P42574	1/20	0.34

▸	ATM	Q13315	1/20	0.34

▸	SENP8	Q96LD8	1/20	0.34

▸	SENP7	Q9BQF6	1/20	0.34

▸	SENP6	Q9GZR1	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.

Compound	similarity	top predicted	shared targets
SCHEMBL6016958	0.96	F10 (0.50)	F10F2NPC1USP2ALDH1A1
SCHEMBL3371303	0.94	F10 (0.56)	F10F2NPC1USP2ALDH1A1
SCHEMBL6016807	0.90	F10 (0.56)	F10F2
SCHEMBL1379952	0.90	F10 (0.56)	F10F2
SCHEMBL3372431	0.86	F10 (0.54)	F10F2ALDH1A1
SCHEMBL3367570	0.83	F10 (0.63)	F10F2
SCHEMBL3370081	0.82	F10 (0.54)	F10F2ALDH1A1
SCHEMBL3369596	0.81	F10 (0.65)	F10F2
SCHEMBL6016900	0.80	F10 (0.57)	F10F2
SCHEMBL1382269	0.80	F10 (0.57)	F10F2

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-1636216-A1	BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS	Sanofi-Aventis Deutschland GmbH (DE)	2006-03-22	—	—	EP	disclosed
WO-2004101553-A1	BENZIMIDAZOLE-DERIVATIVES AS FACTOR Xa INHIBITORS	SANOFI-AVENTIS DEUTSCHLAND GMBH (DE)	2004-11-25	—	—	WO	disclosed