SCHEMBL5406099

CC1(C)CC(=O)c2ccc(C#Cc3ccccn3)nc2C1.CC1(C)CCc2nc(C#Cc3ccccn3)ccc2C1=O.Cc1coc(C#Cc2ccc3c(n2)CC(C)(C)CC3=O)n1.Cc1coc(C#Cc2ccc3c(n2)CCC(C)(C)C3=O)n1.O=C1CCCc2nc(C#Cc3ccccn3)ccc21.O=C1CCCc2nc(C#Cc3nc(F)c(-c4cccnc4)[nH]3)ccc21

nearest known ligand 0.46

Predicted protein targets (top 1)

	gene	UniProt	supporting neighbours	confidence
▸	GRM5	P41594	6/20	0.37

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
SCHEMBL4334716	0.80	GRM5 (0.53)	GRM5
SCHEMBL4321156	0.80	CYP2C19 (0.39)	GRM5
SCHEMBL4330065	0.77	GRM5 (0.48)	GRM5
SCHEMBL4635284	0.73	GRM5 (0.43)	GRM5
SCHEMBL4635243	0.73	GRM5 (0.41)	GRM5
SCHEMBL4634801	0.73	GRM5 (0.56)	GRM5
SCHEMBL4331876	0.71	GRM5 (0.62)	GRM5
SCHEMBL4330040	0.70	CYP2C19 (0.56)	GRM5
SCHEMBL4330704	0.69	GRM5 (0.53)	GRM5
SCHEMBL4332879	0.69	GRM5 (0.73)	GRM5

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
WO-2007023242-A1	TETRAHYDROQUINOLINONES AND THEIR USE AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS	MERZ PHARMA GMBH & CO. KGAA (DE)	2007-03-01	—	—	WO	disclosed