SCHEMBL25864149 — predicted protein targets

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	NLRP3	Q96P20	11/20	0.45

▸	IL1B	P01584	3/20	0.38

▸	KDM4E	B2RXH2	2/20	0.36

▸	HSD17B10	Q99714	1/20	0.36

▸	IRAK4	Q9NWZ3	1/20	0.35

▸	ALDH1A1	P00352	1/20	0.35

▸	LMNA	P02545	1/20	0.35

▸	GAA	P10253	1/20	0.35

▸	HTT	P42858	1/20	0.35

▸	KMT2A	Q03164	1/20	0.35

▸	JAK3	P52333	1/20	0.33

▸	BTK	Q06187	1/20	0.33

▸	ACACB	O00763	1/20	0.33

▸	ACACA	Q13085	1/20	0.33

▸	CCR4	P51679	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
SCHEMBL25855241	0.94	NLRP3 (0.48)	NLRP3IL1BKDM4EHSD17B10IRAK4
SCHEMBL25855094	0.92	NLRP3 (0.45)	NLRP3IL1BKDM4EHSD17B10ALDH1A1
SCHEMBL28934352	0.92	NLRP3 (0.47)	NLRP3IL1BIRAK4
SCHEMBL28934346	0.92	NLRP3 (0.47)	NLRP3IL1BIRAK4
SCHEMBL30108702	0.92	NLRP3 (0.47)	NLRP3IL1BIRAK4
SCHEMBL25855444	0.86	NLRP3 (0.48)	NLRP3IL1BIRAK4
SCHEMBL28934734	0.85	NLRP3 (0.50)	NLRP3IL1BKDM4EHSD17B10IRAK4
SCHEMBL28934737	0.85	NLRP3 (0.50)	NLRP3IL1BKDM4EHSD17B10IRAK4
SCHEMBL25256054	0.84	NLRP3 (0.62)	NLRP3IL1B
SCHEMBL25297240	0.84	NLRP3 (0.62)	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-2023131277-A1	NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF	药捷安康(南京)科技股份有限公司	2023-07-13	—	—	WO	disclosed