SCHEMBL24096644 — predicted protein targets

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	NTRK1	P04629	2/20	0.35

▸	MAPK8	P45983	1/20	0.34

▸	HCRTR1	O43613	2/20	0.34

▸	HCRTR2	O43614	2/20	0.34

▸	POLB	P06746	3/20	0.34

▸	SCN4A	P35499	1/20	0.34

▸	KDM4E	B2RXH2	1/20	0.34

▸	BTK	Q06187	2/20	0.33

▸	ALDH1A1	P00352	1/20	0.33

▸	JAK3	P52333	1/20	0.33

▸	CNR1	P21554	1/20	0.33

▸	CNR2	P34972	1/20	0.33

▸	USP30	Q70CQ3	1/20	0.33

▸	UCHL1	P09936	1/20	0.33

▸	NPC1	O15118	1/20	0.33

▸	ALOX5	P09917	1/20	0.32

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
SCHEMBL24096795	0.85	USP30 (0.42)	POLBBTKCNR1CNR2USP30
SCHEMBL24096735	0.81	BTK (0.46)	BTKALDH1A1CNR1CNR2USP30
SCHEMBL24096739	0.81	BTK (0.46)	BTKALDH1A1CNR1CNR2USP30
SCHEMBL24096927	0.78	JAK3 (0.36)	MAPK8POLBBTKJAK3CNR1
SCHEMBL24096772	0.78	CTSL (0.33)	MAPK8HCRTR1HCRTR2
SCHEMBL24096768	0.78	CTSL (0.33)	MAPK8HCRTR1HCRTR2
SCHEMBL24096869	0.73	HDAC4 (0.46)	BTKUSP30
SCHEMBL24096892	0.73	HDAC4 (0.46)	BTKUSP30
SCHEMBL24096868	0.71	POLB (0.36)	POLB
SCHEMBL24096807	0.70	BTK (0.40)	BTKCNR1CNR2USP30

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-2021249417-A1	HETEROCYCLIC COMPOUND AND DERIVATIVE THEREOF	赛诺哈勃药业（成都）有限公司	2021-12-16	—	—	WO	disclosed