SCHEMBL19909022

Cc1nc(C)nc(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3ccnc(Cc4nc(C)nc(-c5ccc6c(c5)c5cc(-c7nc(C)nc(C)n7)ccc5n6-c5cc(-c6ccncc6)cc(-n6c7ccc(-c8nc(C)nc(C)n8)cc7c7cc(-c8nc(C)nc(C)n8)ccc76)c5C#N)n4)c3)cc(-n3c4ccccc4c4cc(-c5nc(C)nc(C)n5)ccc43)c2C#N)n1

nearest known ligand 0.31

Predicted protein targets (top 2)

	gene	UniProt	supporting neighbours	confidence
▸	PTGER4	P35408	1/20	0.31

▸	PDE10A	Q9Y233	1/20	0.30

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
SCHEMBL19913198	0.88	SQOR (0.35)	PTGER4
SCHEMBL22170355	0.87	PTGER4 (0.31)	PTGER4
SCHEMBL19913197	0.83	KDM4E (0.33)	PDE10A
SCHEMBL19909486	0.82	SQOR (0.35)	—
SCHEMBL19908951	0.79	MEN1 (0.43)	—
SCHEMBL19913183	0.79	PDE9A (0.39)	PTGER4PDE10A
SCHEMBL21414251	0.78	PTGER4 (0.39)	PTGER4
SCHEMBL19913186	0.78	MAPK14 (0.38)	PTGER4PDE10A
SCHEMBL19909023	0.78	PIK3CA (0.34)	PDE10A
SCHEMBL19908876	0.77	SQOR (0.40)	PDE10A

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-3287451-A1	ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES	CYNORA GMBH (DE)	2018-02-28	—	—	EP	disclosed