SCHEMBL30607310

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

nearest known ligand 0.67

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	4/20	0.66

▸	MAPK8	P45983	1/20	0.63

▸	MAPK9	P45984	1/20	0.63

▸	MAPK10	P53779	1/20	0.63

▸	KEAP1	Q14145	1/20	0.61

▸	GLP1R	P43220	6/20	0.60

▸	CRHR1	P34998	1/20	0.60

▸	CRHR2	Q13324	1/20	0.60

▸	F2	P00734	2/20	0.59

▸	GCGR	P47871	5/20	0.58

▸	GIPR	P48546	5/20	0.58

▸	APLNR	P35414	1/20	0.58

▸	NPY2R	P49146	2/20	0.58

▸	NPY4R	P50391	2/20	0.58

▸	NPY5R	Q15761	2/20	0.58

▸	NPY1R	P25929	1/20	0.58

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
SCHEMBL31182932	0.90	CALCR (0.75)	CALCRGLP1RCRHR1CRHR2GCGR
SCHEMBL30436462	0.90	CALCR (0.70)	CALCRKEAP1GLP1RCRHR1CRHR2
SCHEMBL31182609	0.90	CALCR (0.71)	CALCRGLP1RCRHR1CRHR2GCGR
SCHEMBL30436192	0.90	CALCR (0.71)	CALCRGLP1RCRHR1CRHR2F2
SCHEMBL31182915	0.90	CALCR (0.72)	CALCRKEAP1GLP1RCRHR1CRHR2
SCHEMBL31182483	0.89	CALCR (0.71)	CALCRGLP1RCRHR1CRHR2F2
SCHEMBL30358206	0.89	CALCR (0.70)	CALCRKEAP1GLP1RCRHR1CRHR2
SCHEMBL30884870	0.89	CALCR (0.75)	CALCRKEAP1GLP1RCRHR1CRHR2
SCHEMBL30185050	0.89	APLNR (0.62)	CALCRKEAP1GLP1RF2GCGR
SCHEMBL30511775	0.88	CALCR (0.64)	CALCRKEAP1GLP1RCRHR1CRHR2

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