SCHEMBL31442345

SCHEMBL31442345

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 2/20 0.58
▸ KISS1R Q969F8 4/20 0.51
▸ MMP2 P08253 1/20 0.49
▸ MMP9 P14780 1/20 0.49
▸ MMP8 P22894 1/20 0.49
▸ CCKBR P32239 2/20 0.48
▸ ECE1 P42892 2/20 0.47
▸ OPRD1 P41143 2/20 0.47
▸ CCKAR P32238 1/20 0.47
▸ REN P00797 1/20 0.47
▸ OPRM1 P35372 1/20 0.47

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL31442235 0.93 GHSR (0.57) GHSRKISS1RMMP2MMP9MMP8
SCHEMBL31442130 0.91 GHSR (0.55) GHSRKISS1RMMP2MMP9MMP8
SCHEMBL31442126 0.90 GHSR (0.54) GHSRKISS1RMMP2MMP9MMP8
SCHEMBL31442154 0.90 GHSR (0.56) GHSROPRD1OPRM1
SCHEMBL31442128 0.90 GHSR (0.54) GHSRKISS1RMMP2MMP9MMP8
SCHEMBL31442238 0.90 GHSR (0.55) GHSRKISS1RCCKBR
SCHEMBL30736101 0.90 MMP2 (0.60) GHSRKISS1RMMP2MMP9MMP8
SCHEMBL31442242 0.89 GHSR (0.53) GHSRKISS1RMMP2MMP9MMP8
SCHEMBL29705214 0.88 GHSR (0.54) GHSRKISS1RMMP2MMP9MMP8
SCHEMBL29630524 0.87 REN (0.54) GHSRREN

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12234299-B2 Peptides for inducing bacteriocin synthesis and methods to identify and/or select and/or optimize the same SYNGULON S.A. (BE) 2025-02-25 — — US disclosed
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