SCHEMBL31472956

CCCC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)CN)C(C)C)C(=O)N[C@@H](CS)C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	NMUR2	Q9GZQ4	4/20	0.56

▸	NMUR1	Q9HB89	4/20	0.56

▸	TFPI	P10646	4/20	0.55

▸	OPRD1	P41143	5/20	0.54

▸	IL23R	Q5VWK5	1/20	0.54

▸	KDM1A	O60341	1/20	0.52

▸	NTSR1	P30989	1/20	0.52

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
SCHEMBL31472965	0.96	NMUR2 (0.59)	NMUR2NMUR1TFPIOPRD1IL23R
SCHEMBL29934595	0.85	NMUR2 (0.58)	NMUR2NMUR1TFPIOPRD1IL23R
SCHEMBL6889257	0.84	OPRD1 (0.54)	NMUR2NMUR1OPRD1IL23RNTSR1
SCHEMBL6889227	0.84	OPRD1 (0.54)	NMUR2NMUR1OPRD1IL23RNTSR1
SCHEMBL29568732	0.83	NMUR2 (0.47)	NMUR2NMUR1NTSR1
SCHEMBL29695588	0.83	OPRD1 (0.54)	OPRD1IL23R
SCHEMBL29500565	0.83	OPRD1 (0.54)	OPRD1IL23R
SCHEMBL31433237	0.83	NMUR2 (0.61)	NMUR2NMUR1OPRD1NTSR1
SCHEMBL31670651	0.83	NTSR1 (0.56)	OPRD1NTSR1
SCHEMBL29403705	0.82	IL23R (0.55)	OPRD1IL23RKDM1A

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
US-12257327-B2	Compositions and methods for treatment and imaging using nanoparticles	WASHINGTON UNIVERSITY (US)	2025-03-25	—	—	US	disclosed