SCHEMBL31483647

CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C

nearest known ligand 0.60

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	3/20	0.60

▸	OPRM1	P35372	2/20	0.60

▸	CCKAR	P32238	1/20	0.57

▸	CCKBR	P32239	1/20	0.57

▸	ACE	P12821	2/20	0.54

▸	IL23R	Q5VWK5	1/20	0.53

▸	ECE1	P42892	2/20	0.53

▸	LTA4H	P09960	1/20	0.53

▸	REN	P00797	1/20	0.52

▸	GRPR	P30550	1/20	0.51

▸	PLAU	P00749	1/20	0.51

▸	PLAUR	Q03405	1/20	0.51

▸	PSMB8	P28062	1/20	0.51

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
SCHEMBL31070800	0.93	OPRD1 (0.58)	OPRD1OPRM1CCKARCCKBRACE
SCHEMBL25037253	0.86	OPRD1 (0.72)	OPRD1OPRM1CCKARCCKBRIL23R
SCHEMBL25037250	0.86	OPRD1 (0.72)	OPRD1OPRM1CCKARCCKBRIL23R
SCHEMBL30091409	0.84	REN (0.57)	RENPSMB8
SCHEMBL30692600	0.84	OPRD1 (0.64)	OPRD1OPRM1CCKARCCKBRIL23R
SCHEMBL29564479	0.84	OPRD1 (0.61)	OPRD1OPRM1CCKARCCKBRLTA4H
SCHEMBL468832	0.83	ALOX15 (0.69)	ACEECE1
SCHEMBL468831	0.83	ALOX15 (0.69)	ACEECE1
SCHEMBL11227413	0.83	CTSL (0.61)	ACEECE1LTA4HPLAUPLAUR
SCHEMBL11227412	0.83	CTSL (0.61)	ACEECE1LTA4HPLAUPLAUR

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
CN-119615198-A	Electrocatalytic oxidation modification method for indole skeleton-containing compound	浙江工业大学	2025-03-14	—	—	CN	disclosed