SCHEMBL21452840 — predicted protein targets

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	STING1	Q86WV6	18/20	0.55

▸	HDAC3	O15379	1/20	0.40

▸	HDAC4	P56524	1/20	0.40

▸	HDAC1	Q13547	1/20	0.40

▸	HDAC7	Q8WUI4	1/20	0.40

▸	HDAC2	Q92769	1/20	0.40

▸	HDAC10	Q969S8	1/20	0.40

▸	HDAC11	Q96DB2	1/20	0.40

▸	HDAC8	Q9BY41	1/20	0.40

▸	HDAC6	Q9UBN7	1/20	0.40

▸	HDAC9	Q9UKV0	1/20	0.40

▸	HDAC5	Q9UQL6	1/20	0.40

▸	PTPN2	P17706	1/20	0.40

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
SCHEMBL29636406	0.83	STING1 (0.57)	STING1HDAC3HDAC4HDAC1HDAC7
SCHEMBL20022262	0.83	STING1 (0.57)	STING1HDAC3HDAC4HDAC1HDAC7
SCHEMBL21406406	0.77	STING1 (0.82)	STING1
SCHEMBL20563177	0.76	STING1 (0.61)	STING1HDAC3HDAC4HDAC1HDAC7
SCHEMBL20022261	0.75	STING1 (0.66)	STING1HDAC3HDAC4HDAC1HDAC7
SCHEMBL29636423	0.75	STING1 (0.66)	STING1HDAC3HDAC4HDAC1HDAC7
SCHEMBL20353726	0.74	STING1 (0.73)	STING1HDAC3HDAC4HDAC1HDAC7
SCHEMBL29913742	0.74	STING1 (0.73)	STING1HDAC3HDAC4HDAC1HDAC7
SCHEMBL21406509	0.74	STING1 (0.76)	STING1HDAC3HDAC4HDAC1HDAC7
SCHEMBL21406511	0.74	STING1 (0.76)	STING1HDAC3HDAC4HDAC1HDAC7

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-2019195124-A1	BENZOTHIOPHENES AND RELATED COMPOUNDS AS STING AGONISTS	MERCK SHARP & DOHME CORP. (US)	2019-10-10	—	—	WO	disclosed