SCHEMBL21707491 — predicted protein targets

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	HSD11B1	P28845	12/20	0.37

▸	POLB	P06746	1/20	0.34

▸	CYP1A2	P05177	2/20	0.32

▸	USP2	O75604	1/20	0.32

▸	ALDH1A1	P00352	1/20	0.32

▸	LMNA	P02545	1/20	0.32

▸	TSHR	P16473	1/20	0.32

▸	BLM	P54132	1/20	0.32

▸	CACNA2D1	P54289	1/20	0.32

▸	SMN1; SMN2	Q16637	1/20	0.32

▸	MEN1	O00255	1/20	0.31

▸	KMT2A	Q03164	1/20	0.31

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
SCHEMBL5456118	0.83	CYP1A2 (0.39)	HSD11B1POLBCYP1A2USP2ALDH1A1
SCHEMBL5443318	0.83	CYP1A2 (0.39)	HSD11B1POLBCYP1A2USP2ALDH1A1
SCHEMBL5441518	0.83	CYP1A2 (0.39)	HSD11B1POLBCYP1A2USP2ALDH1A1
SCHEMBL7403691	0.83	CYP1A2 (0.39)	HSD11B1POLBCYP1A2USP2ALDH1A1
SCHEMBL5441921	0.83	CYP1A2 (0.39)	HSD11B1POLBCYP1A2USP2ALDH1A1
SCHEMBL5441916	0.83	CYP1A2 (0.39)	HSD11B1POLBCYP1A2USP2ALDH1A1
SCHEMBL24631184	0.77	HSD11B1 (0.33)	HSD11B1POLBCYP1A2USP2ALDH1A1
SCHEMBL5443392	0.76	CYP1A2 (0.39)	HSD11B1POLBCYP1A2USP2ALDH1A1
SCHEMBL5441805	0.76	CYP1A2 (0.39)	HSD11B1POLBCYP1A2USP2ALDH1A1
SCHEMBL6386504	0.76	CYP1A2 (0.39)	HSD11B1POLBCYP1A2USP2ALDH1A1

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-2020029762-A1	PREPARATION METHOD FOR FUSED TRICYCLIC γ-AMINO ACID DERIVATIVE AND INTERMEDIATE THEREOF	四川海思科制药有限公司	2020-02-13	—	—	WO	disclosed