SCHEMBL29746571

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

nearest known ligand 0.65

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.60

▸	NMUR2	Q9GZQ4	4/20	0.57

▸	NMUR1	Q9HB89	4/20	0.57

▸	KISS1R	Q969F8	6/20	0.54

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
SCHEMBL29746772	0.93	KISS1R (0.60)	TFPINMUR2NMUR1KISS1R
SCHEMBL6437697	0.91	TFPI (0.63)	TFPINMUR2NMUR1KISS1R
SCHEMBL6437703	0.91	TFPI (0.63)	TFPINMUR2NMUR1KISS1R
SCHEMBL30553847	0.91	TFPI (0.58)	TFPINMUR2NMUR1KISS1R
SCHEMBL30449457	0.90	TFPI (0.68)	TFPINMUR2NMUR1
SCHEMBL30450082	0.90	TFPI (0.60)	TFPINMUR2NMUR1KISS1R
SCHEMBL29494169	0.88	KISS1R (0.60)	TFPIKISS1R
SCHEMBL29470903	0.88	TFPI (0.64)	TFPIKISS1R
SCHEMBL13912288	0.87	TFPI (0.61)	TFPIKISS1R
SCHEMBL16015184	0.87	TFPI (0.61)	TFPIKISS1R

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
CN-107406480-B	Peptide synthesis method	JITSUBO株式会社	2022-06-24	—	—	CN	disclosed