SCHEMBL4081939

CC(C)(C(=O)N(c1ccc2ccccc2n1)N(C(=O)C(C)(C)S(=O)(=O)c1ccc(Cl)cc1F)c1nc(-c2ccc(Cl)cc2)cs1)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C(=O)Nc1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C(=O)Nc1cccc2ccccc12)S(=O)(=O)c1ccc(Cl)cc1F.CC(C)(C)Cc1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)on1.CCCc1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)on1.Cc1ccc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2F)nc1

nearest known ligand 0.31

Predicted protein targets (top 2)

	gene	UniProt	supporting neighbours	confidence
▸	CNR2	P34972	2/20	0.31

▸	CNR1	P21554	1/20	0.31

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
SCHEMBL4081933	0.91	CNR2 (0.33)	CNR2CNR1
SCHEMBL1465189	0.68	MAPK14 (0.46)	CNR2CNR1
SCHEMBL3963561	0.68	MAPK14 (0.34)	—
SCHEMBL1464666	0.65	CNR2 (0.43)	CNR2CNR1
SCHEMBL1463942	0.64	MAPK14 (0.50)	CNR2CNR1
SCHEMBL3968553	0.63	MAPK14 (0.35)	CNR2
SCHEMBL3959989	0.62	MAPK14 (0.43)	CNR2CNR1
SCHEMBL3960770	0.61	CNR2 (0.53)	CNR2CNR1
SCHEMBL1463707	0.61	RAB9A (0.52)	CNR2CNR1
SCHEMBL1464367	0.61	CNR2 (0.74)	CNR2CNR1

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
EP-2081905-A2	SULFONYL COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR	Boehringer Ingelheim International GmbH (DE)	2009-07-29	—	—	EP	claimed