SCHEMBL30624971 — predicted protein targets

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	IL1B	P01584	9/20	0.51

▸	NLRP3	Q96P20	8/20	0.48

▸	KCNH2	Q12809	1/20	0.39

▸	CCNK	O75909	1/20	0.38

▸	CDK7	P50613	1/20	0.38

▸	CCNH	P51946	1/20	0.38

▸	MNAT1	P51948	1/20	0.38

▸	CDK12	Q9NYV4	1/20	0.38

▸	JAK2	O60674	2/20	0.37

▸	JAK3	P52333	2/20	0.37

▸	CCRL2	O00421	1/20	0.36

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
SCHEMBL30624633	0.90	IL1B (0.58)	IL1BNLRP3KCNH2
SCHEMBL26435853	0.86	IL1B (0.53)	IL1BNLRP3KCNH2
SCHEMBL30039618	0.84	IL1B (0.71)	IL1BNLRP3
SCHEMBL26435689	0.84	IL1B (0.71)	IL1BNLRP3
SCHEMBL26092927	0.84	IL1B (0.71)	IL1BNLRP3
SCHEMBL30624889	0.82	IL1B (0.56)	IL1BNLRP3KCNH2
SCHEMBL29131867	0.81	IL1B (0.59)	IL1BNLRP3KCNH2
SCHEMBL29131861	0.81	IL1B (0.59)	IL1BNLRP3KCNH2
SCHEMBL26435900	0.80	IL1B (0.53)	IL1BNLRP3KCNH2
SCHEMBL30379299	0.80	IL1B (0.54)	IL1BNLRP3KCNH2

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
CN-116969920-A	Fused pyridazine derivative, preparation method and medical application thereof	上海辉启生物医药科技有限公司	2023-10-31	—	—	CN	disclosed