SCHEMBL30607276

CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C

nearest known ligand 0.68

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	C5AR1	P21730	2/20	0.68

▸	NPY1R	P25929	1/20	0.67

▸	NPY2R	P49146	1/20	0.67

▸	NPY4R	P50391	1/20	0.67

▸	NPY5R	Q15761	1/20	0.67

▸	IL23R	Q5VWK5	1/20	0.64

▸	CXCR4	P61073	6/20	0.63

▸	CALCA	P06881	2/20	0.61

▸	MC4R	P32245	1/20	0.59

▸	MC5R	P33032	1/20	0.59

▸	MC3R	P41968	1/20	0.59

▸	MC1R	Q01726	1/20	0.59

▸	KISS1R	Q969F8	3/20	0.59

▸	GLP1R	P43220	2/20	0.59

▸	GCGR	P47871	2/20	0.59

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
SCHEMBL30607479	0.90	NPY1R (0.68)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL30527897	0.90	NPY1R (0.68)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL31482959	0.89	CXCR4 (0.67)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL29625326	0.89	NPY1R (0.72)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL29672871	0.89	IL23R (0.70)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL30824296	0.88	NPY2R (0.74)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL31683347	0.88	NPY2R (0.71)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL31182571	0.88	NPY2R (0.71)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL31182642	0.88	NPY1R (0.73)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL29351718	0.88	NPY1R (0.71)	C5AR1NPY1RNPY2RNPY4RNPY5R

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