SCHEMBL23970928 — predicted protein targets

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	USP30	Q70CQ3	8/20	0.47

▸	SCN9A	Q15858	1/20	0.44

▸	HDAC4	P56524	1/20	0.43

▸	HDAC6	Q9UBN7	1/20	0.43

▸	PARP1	P09874	1/20	0.42

▸	ANO1	Q5XXA6	2/20	0.40

▸	RIPK1	Q13546	1/20	0.40

▸	PBK	Q96KB5	1/20	0.40

▸	CNR1	P21554	1/20	0.39

▸	CNR2	P34972	1/20	0.39

▸	FPR3	P25089	1/20	0.39

▸	FPR2	P25090	1/20	0.39

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
SCHEMBL23970657	0.91	USP30 (0.44)	USP30SCN9AHDAC4HDAC6PARP1
SCHEMBL23970663	0.90	USP30 (0.45)	USP30SCN9AHDAC4HDAC6PARP1
SCHEMBL23970930	0.90	USP30 (0.45)	USP30SCN9AHDAC4HDAC6PARP1
SCHEMBL13088963	0.90	USP30 (0.46)	USP30HDAC4HDAC6PARP1ANO1
SCHEMBL23970662	0.90	USP30 (0.49)	USP30SCN9AHDAC4HDAC6PARP1
SCHEMBL23970924	0.90	USP30 (0.49)	USP30SCN9AHDAC4HDAC6PARP1
SCHEMBL23971053	0.90	USP30 (0.44)	USP30SCN9AHDAC4HDAC6PARP1
SCHEMBL23971296	0.90	USP30 (0.44)	USP30SCN9AHDAC4HDAC6PARP1
SCHEMBL23970931	0.90	USP30 (0.44)	USP30SCN9AHDAC4HDAC6PARP1
SCHEMBL23970923	0.89	USP30 (0.48)	USP30SCN9AHDAC4HDAC6PARP1

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-2021222353-A1	MACROCYCLIC INHIBITORS OF PEPTIDYLARGININE DEIMINASES	GILEAD SCIENCES, INC. (US)	2021-11-04	—	—	WO	disclosed