SCHEMBL31210211

CCCC[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)CC)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	OPRL1	P41146	5/20	0.49

▸	OPRM1	P35372	5/20	0.49

▸	OPRD1	P41143	5/20	0.49

▸	KISS1R	Q969F8	2/20	0.49

▸	OPRK1	P41145	1/20	0.48

▸	ECE1	P42892	1/20	0.48

▸	GLP1R	P43220	1/20	0.48

▸	MUS81	Q96NY9	1/20	0.48

▸	QRFPR	Q96P65	1/20	0.47

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
SCHEMBL31307267	0.92	OPRM1 (0.56)	OPRL1OPRM1OPRD1KISS1ROPRK1
SCHEMBL31462020	0.89	OPRM1 (0.55)	OPRM1OPRD1KISS1ROPRK1
SCHEMBL31462115	0.89	OPRM1 (0.52)	OPRM1OPRD1KISS1ROPRK1
SCHEMBL31462043	0.89	KISS1R (0.53)	OPRM1OPRD1KISS1ROPRK1
SCHEMBL29568969	0.86	OPRL1 (0.49)	OPRL1OPRM1OPRD1OPRK1
SCHEMBL31462010	0.86	QRFPR (0.52)	OPRL1OPRM1OPRD1OPRK1QRFPR
SCHEMBL31461954	0.86	TFPI (0.52)	OPRM1OPRD1KISS1ROPRK1
SCHEMBL9149411	0.85	NPY4R (0.49)	OPRL1OPRM1OPRD1OPRK1QRFPR
SCHEMBL31462110	0.85	QRFPR (0.55)	OPRM1OPRD1KISS1ROPRK1QRFPR
SCHEMBL9149396	0.85	NPY4R (0.49)	OPRL1OPRM1OPRD1OPRK1QRFPR

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-118613284-A	Compositions and methods for oral administration	想象制药有限责任公司	2024-09-06	—	—	CN	disclosed