SCHEMBL30607341

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	4/20	0.67

▸	EP300	Q09472	1/20	0.64

▸	HIF1A	Q16665	1/20	0.64

▸	F2	P00734	4/20	0.63

▸	NPY2R	P49146	7/20	0.62

▸	NPY4R	P50391	7/20	0.62

▸	NPY5R	Q15761	7/20	0.62

▸	NPY1R	P25929	5/20	0.62

▸	KEAP1	Q14145	1/20	0.62

▸	GLP1R	P43220	1/20	0.61

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
SCHEMBL31148886	0.90	CALCR (0.70)	CALCREP300HIF1AF2NPY2R
SCHEMBL31182486	0.90	CALCR (0.69)	CALCRF2NPY2RNPY4RNPY5R
SCHEMBL31182661	0.90	F2 (0.65)	CALCREP300HIF1AF2NPY2R
SCHEMBL30432875	0.90	CALCR (0.65)	CALCRF2NPY2RNPY4RNPY5R
SCHEMBL29939723	0.89	CALCR (0.79)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30721598	0.89	CALCR (0.76)	CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30721562	0.89	CALCR (0.76)	CALCRF2NPY2RNPY4RNPY5R
SCHEMBL30721567	0.89	CALCR (0.76)	CALCRF2NPY2RNPY4RNPY5R
SCHEMBL30721550	0.89	CALCR (0.76)	CALCRF2NPY2RNPY4RNPY5R
SCHEMBL30721659	0.89	CALCR (0.76)	CALCRF2NPY2RNPY4RNPY5R

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