SCHEMBL23508647 — predicted protein targets

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	USP2	O75604	2/20	0.38

▸	CYP11B1	P15538	2/20	0.34

▸	CYP11B2	P19099	2/20	0.34

▸	CYP2D6	P10635	2/20	0.33

▸	CYP2C9	P11712	1/20	0.33

▸	TSHR	P16473	1/20	0.33

▸	HSD17B10	Q99714	1/20	0.33

▸	CYP3A4	P08684	2/20	0.32

▸	CYP1A2	P05177	1/20	0.30

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
SCHEMBL23509081	0.96	USP2 (0.36)	USP2CYP11B1CYP11B2CYP2D6CYP2C9
SCHEMBL357309	0.92	CYP11B1 (0.37)	CYP11B1CYP11B2TSHRCYP1A2
SCHEMBL4406755	0.88	USP2 (0.33)	USP2CYP3A4
SCHEMBL15962732	0.84	USP2 (0.45)	USP2CYP2D6CYP2C9TSHRHSD17B10
SCHEMBL25049534	0.84	USP2 (0.45)	USP2CYP2D6CYP2C9TSHRHSD17B10
SCHEMBL24713778	0.79	USP2 (0.36)	USP2CYP11B1CYP11B2CYP2D6TSHR
SCHEMBL15451904	0.79	USP2 (0.36)	USP2CYP11B1CYP11B2CYP2D6TSHR
SCHEMBL24713161	0.79	USP2 (0.36)	USP2CYP11B1CYP11B2CYP2D6TSHR
SCHEMBL23508665	0.78	USP2 (0.40)	USP2CYP2D6CYP2C9TSHRHSD17B10
SCHEMBL14154426	0.78	CYP1A2 (0.37)	CYP2D6TSHRCYP1A2

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-2021115286-A1	SIX-MEMBERED AND FIVE-MEMBERED AROMATIC RING DERIVATIVE CONTAINING NITROGEN HETEROATOMS WHICH CAN BE USED AS SHP2 INHIBITOR	成都倍特药业股份有限公司	2021-06-17	—	—	WO	disclosed