SCHEMBL30607386

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	MC4R	P32245	1/20	0.61

▸	F2	P00734	4/20	0.59

▸	TFPI	P10646	4/20	0.58

▸	NMUR2	Q9GZQ4	3/20	0.58

▸	NMUR1	Q9HB89	3/20	0.58

▸	APLNR	P35414	2/20	0.58

▸	CXCR4	P61073	2/20	0.55

▸	RAMP3	O60896	1/20	0.54

▸	CALCR	P30988	1/20	0.54

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
SCHEMBL30176412	0.89	MC4R (0.63)	MC4RF2TFPINMUR2NMUR1
SCHEMBL31182655	0.88	MC4R (0.67)	MC4RF2TFPINMUR2NMUR1
SCHEMBL30262194	0.87	APLNR (0.57)	F2TFPIAPLNRRAMP3CALCR
SCHEMBL29525577	0.87	APLNR (0.64)	MC4RTFPIAPLNR
SCHEMBL29526046	0.87	APLNR (0.64)	MC4RTFPIAPLNR
SCHEMBL30883205	0.87	F2 (0.61)	MC4RF2TFPIAPLNRRAMP3
SCHEMBL29525492	0.86	APLNR (0.64)	MC4RTFPIAPLNR
SCHEMBL29526390	0.86	APLNR (0.64)	TFPIAPLNR
SCHEMBL3864010	0.86	NMUR2 (0.56)	NMUR2NMUR1APLNR
SCHEMBL3863996	0.86	NMUR2 (0.56)	NMUR2NMUR1APLNR

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