SCHEMBL30712967

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.73

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	10/20	0.69

▸	NPY4R	P50391	8/20	0.69

▸	NPY5R	Q15761	8/20	0.69

▸	NPY1R	P25929	8/20	0.69

▸	EP300	Q09472	1/20	0.63

▸	HIF1A	Q16665	1/20	0.63

▸	CALCR	P30988	5/20	0.59

▸	TFPI	P10646	1/20	0.57

▸	VIPR2	P41587	1/20	0.57

▸	RAMP3	O60896	1/20	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
SCHEMBL30073930	0.93	NPY2R (0.70)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30435943	0.92	NPY2R (0.65)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30888269	0.90	NPY2R (0.70)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL29903364	0.90	NPY2R (0.68)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL31182450	0.89	NPY2R (0.66)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL8931244	0.89	NPY2R (0.68)	NPY2RNPY4RNPY5RNPY1REP300
SCHEMBL30883237	0.89	NPY2R (0.63)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30712913	0.89	NPY2R (0.64)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30883235	0.88	NPY2R (0.59)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30429446	0.88	NPY2R (0.65)	NPY2RNPY4RNPY5RNPY1REP300

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-20240003881-A1	SYSTEM AND METHOD FOR RAPID AND SENSITIVE DETECTION OF ANTI-PATHOGEN ANTIBODIES	THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA)	2024-01-04	—	—	US	disclosed