SCHEMBL3967536

CC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(C#N)cc2)no1.CC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)c2cccnc2)no1.CC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccsc2)no1.CC(C)(C)c1csc(NC(=O)C(C)(C)S(=O)(=O)c2cccnc2)n1.COc1ccc(S(=O)(=O)C(C)(C)C(=O)Nc2cc(C(C)(C)C)on2)cc1F

nearest known ligand 0.40

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	CNR2	P34972	4/20	0.40

▸	CNR1	P21554	3/20	0.40

▸	NAMPT	P43490	2/20	0.34

▸	SMN1; SMN2	Q16637	1/20	0.33

▸	FLT3	P36888	5/20	0.33

▸	MAPK1	P28482	1/20	0.32

▸	CTPS1	P17812	1/20	0.32

▸	ALPL	P05186	1/20	0.32

▸	BRAF	P15056	2/20	0.31

▸	NTRK1	P04629	1/20	0.31

▸	RET	P07949	1/20	0.31

▸	RAF1	P04049	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
SCHEMBL3962771	0.88	CNR2 (0.51)	CNR2CNR1FLT3BRAFRAF1
SCHEMBL1465008	0.75	CNR2 (0.66)	CNR2CNR1SMN1; SMN2FLT3BRAF
SCHEMBL1465065	0.71	SMN1; SMN2 (0.52)	SMN1; SMN2MAPK1CTPS1
SCHEMBL1464597	0.71	CNR2 (0.67)	CNR2CNR1SMN1; SMN2FLT3RAF1
SCHEMBL1464614	0.71	CNR2 (0.73)	CNR2CNR1SMN1; SMN2
SCHEMBL3960143	0.71	CNR2 (0.52)	CNR2CNR1SMN1; SMN2FLT3MAPK1
SCHEMBL1464387	0.71	CNR2 (0.68)	CNR2CNR1SMN1; SMN2
SCHEMBL3963557	0.70	CNR2 (0.56)	CNR2CNR1SMN1; SMN2FLT3MAPK1
SCHEMBL3963555	0.69	CNR2 (0.55)	CNR2CNR1SMN1; SMN2FLT3MAPK1
SCHEMBL3963097	0.68	CNR2 (0.54)	CNR2CNR1SMN1; SMN2

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-2081905-A2	SULFONYL COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR	Boehringer Ingelheim International GmbH (DE)	2009-07-29	—	—	EP	disclosed
WO-2008014199-A2	SULFONYL COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR	BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE)	2008-01-31	—	—	WO	disclosed