SCHEMBL29526062

CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.64

▸	GLP1R	P43220	4/20	0.54

▸	BACE1	P56817	3/20	0.54

▸	OPRM1	P35372	2/20	0.53

▸	OPRD1	P41143	2/20	0.53

▸	OPRK1	P41145	2/20	0.53

▸	NPBWR1	P48145	1/20	0.53

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
SCHEMBL30861917	0.97	TFPI (0.61)	TFPIGLP1ROPRM1OPRD1OPRK1
SCHEMBL29525489	0.94	TFPI (0.63)	TFPIOPRM1OPRD1OPRK1NPBWR1
SCHEMBL30271990	0.92	TFPI (0.67)	TFPIGLP1RBACE1
SCHEMBL30721576	0.91	TFPI (0.61)	TFPIOPRM1OPRD1OPRK1NPBWR1
SCHEMBL34468124	0.91	TFPI (0.60)	TFPIOPRM1OPRD1OPRK1NPBWR1
SCHEMBL30271991	0.91	TFPI (0.66)	TFPIGLP1R
SCHEMBL30429902	0.90	TFPI (0.68)	TFPIGLP1RBACE1
SCHEMBL30836920	0.90	TFPI (0.66)	TFPIGLP1R
SCHEMBL29375967	0.90	TFPI (0.59)	TFPIOPRM1OPRD1OPRK1NPBWR1
SCHEMBL30662329	0.88	TFPI (0.61)	TFPIBACE1OPRM1OPRD1OPRK1

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-3983065-A1	NOVEL PEPTIDE HORMONE ANALOGUES	IP2IPO Innovations Limited (GB)	2022-04-20	—	—	EP	disclosed