SCHEMBL4552673

CN(c1ccc(F)cc1)c1cnc(Nc2cccc(O)c2)nc1.CN(c1ccc(F)cc1)c1cnc(Nc2ccccc2)nc1.CN(c1ccccc1)c1cnc(Nc2cccc(O)c2)nc1.Oc1cccc(Nc2cnc(Nc3cccc(O)c3)nc2)c1.Oc1cccc(Nc2ncc(Oc3ccc(F)cc3)cn2)c1

nearest known ligand 0.60

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	APP	P05067	1/20	0.60

▸	SYK	P43405	12/20	0.43

▸	SCN9A	Q15858	4/20	0.41

▸	CYP3A4	P08684	1/20	0.40

▸	TSHR	P16473	1/20	0.40

▸	AURKA	O14965	2/20	0.39

▸	MAPK8	P45983	1/20	0.38

▸	AURKB	Q96GD4	1/20	0.38

▸	CDK19	Q9BWU1	1/20	0.38

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
SCHEMBL3592236	0.85	APP (0.55)	APPSYKAURKAMAPK8AURKB
SCHEMBL4421485	0.85	APP (0.58)	APPSYK
SCHEMBL3600524	0.84	APP (0.62)	APPSYKAURKAMAPK8AURKB
SCHEMBL3595608	0.82	APP (0.62)	APPSYKCYP3A4TSHRAURKA
SCHEMBL3590852	0.80	KCNH3 (0.51)	SYKAURKAMAPK8AURKB
SCHEMBL3596154	0.77	KCNH2 (0.51)	SYKSCN9ACYP3A4TSHRAURKA
SCHEMBL3602388	0.76	APP (1.00)	APPSYKTSHR
SCHEMBL3584904	0.76	SYK (0.58)	APPSYKCYP3A4AURKA
SCHEMBL3595433	0.75	KDR (0.46)	APPSYKAURKA
SCHEMBL3595604	0.74	CDK8 (0.49)	APPSYKSCN9A

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-2010502-A1	PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES	Senexis Limited (GB)	2009-01-07	—	—	EP	disclosed
WO-2007125351-A1	PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES	SENEXIS LIMITED (GB)	2007-11-08	—	—	WO	disclosed