SCHEMBL26435680 — predicted protein targets

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	NLRP3	Q96P20	9/20	0.44

▸	IL1B	P01584	8/20	0.41

▸	KCNH2	Q12809	1/20	0.37

▸	CAMK2D	Q13557	1/20	0.37

▸	BRD4	O60885	1/20	0.37

▸	TNF	P01375	1/20	0.37

▸	JUN	P05412	2/20	0.37

▸	MAPK8	P45983	2/20	0.37

▸	MAPK9	P45984	2/20	0.37

▸	DRD4	P21917	1/20	0.37

▸	CDK2	P24941	1/20	0.37

▸	MAPK10	P53779	1/20	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
SCHEMBL26436176	0.94	NLRP3 (0.44)	NLRP3IL1BKCNH2CAMK2DBRD4
SCHEMBL26435685	0.93	NLRP3 (0.44)	NLRP3IL1BKCNH2BRD4TNF
SCHEMBL26435337	0.93	NLRP3 (0.44)	NLRP3IL1BKCNH2BRD4TNF
SCHEMBL26435647	0.90	IL1B (0.55)	NLRP3IL1BKCNH2TNF
SCHEMBL26435060	0.90	NLRP3 (0.49)	NLRP3IL1BKCNH2CAMK2DTNF
SCHEMBL26435881	0.88	NLRP3 (0.50)	NLRP3IL1BCAMK2DJUNMAPK8
SCHEMBL26437132	0.87	NLRP3 (0.47)	NLRP3CAMK2DJUNMAPK8MAPK9
SCHEMBL26436179	0.87	NLRP3 (0.44)	NLRP3IL1BKCNH2BRD4TNF
SCHEMBL26435656	0.86	IL1B (0.56)	NLRP3IL1B
SCHEMBL26438744	0.86	IL1B (0.56)	NLRP3IL1B

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-2023066377-A1	NITROGEN-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF	索智生物科技（浙江）有限公司	2023-04-27	—	—	WO	disclosed