SCHEMBL7634892

CCOC(=O)CN1CCN(CC2CN(c3ccc(C(=N)NC(=O)OC)cc3)C(=O)O2)CC1=O.COC(=O)NC(=N)c1ccc(N2CC(COS(C)(=O)=O)OC2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	ITGB3	P05106	7/20	0.51

▸	ITGA2B	P08514	7/20	0.51

▸	PRSS1	P07477	6/20	0.38

▸	PRSS2	P07478	6/20	0.38

▸	PRSS3	P35030	6/20	0.38

▸	F10	P00742	7/20	0.37

▸	GRM2	Q14416	1/20	0.37

▸	SIGMAR1	Q99720	8/20	0.35

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
SCHEMBL7634323	0.93	ITGB3 (0.46)	ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7313929	0.93	ITGB3 (0.58)	ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7633242	0.92	ITGB3 (0.50)	ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7639220	0.92	ITGB3 (0.45)	ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7642236	0.92	ITGB3 (0.46)	ITGB3ITGA2BPRSS1PRSS2PRSS3
Gantofiban SCHEMBL7633249	0.91	ITGB3 (0.61)	ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7634950	0.90	ITGB3 (0.46)	ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7639353	0.90	ITGB3 (0.45)	ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7634278	0.89	ITGB3 (0.45)	ITGB3ITGA2BPRSS1PRSS2PRSS3
SCHEMBL7639414	0.89	ITGB3 (0.44)	ITGB3ITGA2BPRSS1PRSS2PRSS3

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-6455529-B1	OXAZOLIDIN-2-ONE DERIVATIVES; ANTICOAGULANTS; ANTIMETASTASIS, ANTICARCINOGENIC, ANTIISCHEMIC, AND ANTIINFLAMMATORY AGENTS; OSTEOPOROSIS, ARTERIOSCLEROSIS	MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE)	2002-09-24	—	—	US	disclosed