SCHEMBL31015641 — predicted protein targets

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	CDK2	P24941	10/20	0.40

▸	MAOA	P21397	3/20	0.38

▸	MAOB	P27338	3/20	0.38

▸	KDR	P35968	1/20	0.38

▸	LRRK2	Q5S007	1/20	0.37

▸	CDK5	Q00535	1/20	0.34

▸	CDK5R1	Q15078	1/20	0.34

▸	TGM2	P21980	1/20	0.33

▸	CES1	P23141	1/20	0.33

▸	BRD4	O60885	1/20	0.33

▸	FLT3	P36888	1/20	0.33

▸	KDM4E	B2RXH2	1/20	0.33

▸	ALDH1A1	P00352	1/20	0.33

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
SCHEMBL30872149	0.78	TGM2 (0.46)	CDK2KDRLRRK2CDK5CDK5R1
SCHEMBL26644600	0.78	TGM2 (0.46)	CDK2KDRLRRK2CDK5CDK5R1
SCHEMBL31015728	0.75	CDK2 (0.39)	CDK2KDRLRRK2TGM2
SCHEMBL31015666	0.74	CDK2 (0.40)	CDK2MAOAMAOBKDRTGM2
SCHEMBL31015656	0.74	CDK2 (0.40)	CDK2KDRTGM2
SCHEMBL30872132	0.73	ATG4B (0.47)	MAOAMAOBKDRLRRK2
SCHEMBL31015679	0.73	TLK2 (0.43)	CDK2KDRCDK5CDK5R1TGM2
SCHEMBL31015756	0.72	CDK2 (0.39)	CDK2KDRTGM2CES1BRD4
SCHEMBL11174222	0.71	CDK5 (0.59)	CDK2CDK5CDK5R1BRD4KDM4E
SCHEMBL27454006	0.68	CDK5 (0.51)	CDK2KDRCDK5CDK5R1BRD4

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-2024153246-A1	SUBSTITUTED TRICYCLIC COMPOUND AND USE THEREOF	海南先声再明医药股份有限公司	2024-07-25	—	—	WO	disclosed