SCHEMBL30607489

CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)[C@@H](C)O)C(C)C

nearest known ligand 0.65

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	3/20	0.65

▸	OPRD1	P41143	3/20	0.65

▸	OPRK1	P41145	2/20	0.65

▸	NPY2R	P49146	7/20	0.59

▸	NPY4R	P50391	7/20	0.59

▸	NPY5R	Q15761	7/20	0.59

▸	NPY1R	P25929	5/20	0.59

▸	CALCR	P30988	3/20	0.57

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
SCHEMBL30966632	0.89	NPY2R (0.59)	OPRM1OPRD1OPRK1NPY2RNPY4R
SCHEMBL11664809	0.89	CALCR (0.63)	OPRM1OPRD1OPRK1NPY2RNPY4R
SCHEMBL11667794	0.89	CALCR (0.64)	OPRM1OPRD1OPRK1NPY2RNPY4R
SCHEMBL11650961	0.88	OPRD1 (0.60)	OPRM1OPRD1OPRK1CALCR
SCHEMBL30906483	0.88	NPY2R (0.63)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29679890	0.88	OPRM1 (0.63)	OPRM1OPRD1OPRK1NPY2RNPY4R
SCHEMBL30428290	0.88	CALCR (0.65)	OPRM1OPRD1OPRK1NPY2RNPY4R
SCHEMBL31000913	0.88	CALCR (0.66)	OPRM1OPRD1OPRK1NPY2RNPY4R
SCHEMBL11652679	0.88	CALCR (0.65)	OPRM1OPRD1OPRK1NPY2RNPY4R
SCHEMBL11651841	0.88	CALCR (0.65)	OPRM1OPRD1OPRK1NPY2RNPY4R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-12383505-B2	Nanoparticle for the remodeling of cancer-associated fibroblasts	UNIVERSITY OF SOUTH CAROLINA (US)	2025-08-12	—	—	US	disclosed
US-20230310331-A1	NANOPARTICLE FOR THE REMODELING OF CANCER-ASSOCIATED FIBROBLASTS	UNIVERSITY OF SOUTH CAROLINA (US)	2023-10-05	—	—	US	disclosed