SCHEMBL29707431

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

nearest known ligand 0.62

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	MC4R	P32245	1/20	0.62

▸	C5AR1	P21730	1/20	0.61

▸	TFPI	P10646	6/20	0.60

▸	KDM1A	O60341	3/20	0.58

▸	MAOB	P27338	1/20	0.58

▸	KDM5A	P29375	1/20	0.58

▸	KDM1B	Q8NB78	1/20	0.58

▸	CALCR	P30988	5/20	0.57

▸	NPY1R	P25929	1/20	0.57

▸	NPY2R	P49146	1/20	0.57

▸	NPY4R	P50391	1/20	0.57

▸	NPY5R	Q15761	1/20	0.57

▸	RAMP1	O60894	1/20	0.57

▸	RAMP2	O60895	1/20	0.57

▸	RAMP3	O60896	1/20	0.57

▸	CALCRL	Q16602	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
SCHEMBL29707438	0.91	TFPI (0.62)	TFPI
SCHEMBL31182486	0.90	CALCR (0.69)	TFPICALCRNPY1RNPY2RNPY4R
SCHEMBL30262194	0.89	APLNR (0.57)	TFPIKDM1ACALCRNPY1RNPY2R
SCHEMBL29901567	0.89	TFPI (0.60)	C5AR1TFPI
SCHEMBL29901577	0.89	TFPI (0.60)	C5AR1TFPI
SCHEMBL30495765	0.89	NPY2R (0.64)	TFPIKDM1ACALCRNPY1RNPY2R
SCHEMBL30436793	0.89	NPY2R (0.63)	MC4RTFPIKDM1AMAOBKDM5A
SCHEMBL30818412	0.89	CALCR (0.69)	TFPICALCRNPY1RNPY2RNPY4R
SCHEMBL30433090	0.88	CALCR (0.64)	C5AR1CALCRNPY1RNPY2RNPY4R
SCHEMBL30712933	0.88	C5AR1 (0.62)	C5AR1KDM1AMAOBKDM5AKDM1B

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
EP-4023295-A1	VEGF-REGULATING PEPTIDES	IDP Discovery Pharma, S.L. (ES)	2022-07-06	—	—	EP	disclosed