SCHEMBL4172767

CC(C)CCS(=O)(=O)C(C)(C)C(=O)Nc1cc(C(C)(C)C)nn1C.CC(C)CCS(=O)(=O)C(C)(C)C(=O)Nc1cc(C(C)(C)C)on1.Cn1nc(C(C)(C)C)cc1NC(=O)C(C)(C)S(=O)(=O)C[C@H]1CCC(=O)N1

nearest known ligand 0.46

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	CNR2	P34972	15/20	0.46

▸	CNR1	P21554	8/20	0.37

▸	EGFR	P00533	1/20	0.33

▸	GAA	P10253	1/20	0.33

▸	HPGD	P15428	1/20	0.33

▸	NPC1	O15118	1/20	0.32

▸	SMN1; SMN2	Q16637	1/20	0.32

▸	MAPK14	Q16539	1/20	0.32

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
SCHEMBL4172770	1.00	CNR2 (0.46)	CNR2CNR1EGFRGAAHPGD
SCHEMBL4153149	0.87	CNR2 (0.59)	CNR2CNR1EGFRGAAHPGD
SCHEMBL4010142	0.84	CNR2 (0.49)	CNR2MAPK14
SCHEMBL1621111	0.84	CNR2 (0.49)	CNR2MAPK14
SCHEMBL4010140	0.84	CNR2 (0.49)	CNR2MAPK14
SCHEMBL1621119	0.84	CNR2 (0.49)	CNR2MAPK14
SCHEMBL1621107	0.84	CNR2 (0.49)	CNR2MAPK14
SCHEMBL4176963	0.83	CNR2 (0.49)	CNR2CNR1NPC1SMN1; SMN2
SCHEMBL4160813	0.83	CNR2 (0.49)	CNR2CNR1NPC1SMN1; SMN2
SCHEMBL4156579	0.82	CNR2 (0.54)	CNR2CNR1EGFRGAAHPGD

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-2074084-A1	COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR	Boehringer Ingelheim International GmbH (DE)	2009-07-01	—	—	EP	claimed
WO-2008039645-A1	COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR	BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE)	2008-04-03	—	—	WO	claimed