SCHEMBL7962800

Cc1cc(C)c(S(=O)(=O)NC(CNC(=O)c2ccc(-c3cccc(N/C(=N/C(=O)OC(C)(C)C)NC(=O)NCc4ccccc4)c3)s2)C(=O)OC(C)(C)C)c(C)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	ITGB3	P05106	19/20	0.53

▸	ITGAV	P06756	19/20	0.53

▸	ITGA2B	P08514	7/20	0.53

▸	ITGB1	P05556	6/20	0.53

▸	ITGA5	P08648	6/20	0.53

▸	ITGB5	P18084	6/20	0.53

▸	ACKR3	P25106	1/20	0.38

▸	ALB	P02768	1/20	0.38

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
SCHEMBL7455915	1.00	ITGB3 (0.53)	ITGB3ITGAVITGA2BITGB1ITGA5
SCHEMBL7447593	0.83	ITGB3 (0.64)	ITGB3ITGAVITGA2BITGB1ITGA5
SCHEMBL7455287	0.81	ACKR3 (0.46)	ACKR3
SCHEMBL7455289	0.81	ACKR3 (0.46)	ACKR3
SCHEMBL7452431	0.80	ACKR3 (0.43)	ITGB3ITGAVACKR3
SCHEMBL7446807	0.78	ITGAV (0.62)	ITGB3ITGAVITGA2BITGB1ITGA5
SCHEMBL7447596	0.77	ITGAV (0.64)	ITGB3ITGAVITGA2BITGB1ITGA5
SCHEMBL7447358	0.77	ITGAV (0.56)	ITGB3ITGAVITGA2BITGB1ITGA5
SCHEMBL7455550	0.74	ITGAV (0.51)	ITGB3ITGAVITGA2BITGB1ITGA5
SCHEMBL7455544	0.74	ITGAV (0.51)	ITGB3ITGAVITGA2BITGB1ITGA5

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-6274620-B1	2-BENZENESULFONYLAMINO-3-((5-BROMO-THIOPHENE-2-CARBONYL)-AMINO )PROPIONIC ACID-TERT-BUTYL ESTERS AS ANGIOGENESIS INHIBITORS; ANTICARCINOGENIC AGENTS; OSTEOPOROSIS, RESTENOSIS, AND OCULAR NEOVASCULARIZATION	BIOCHEM PHARMA INC. (CA)	2001-08-14	—	—	US	disclosed