SCHEMBL14615484

SCHEMBL14615484

NC(=O)N[C@@H](Cc1csc2ccccc12)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)C1(N)CCNCC1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.51
MC1R Q01726 5/20 0.38
MC5R P33032 2/20 0.38
KLKB1 P03952 3/20 0.37
KLK1 P06870 2/20 0.37
MC4R P32245 3/20 0.36
MC3R P41968 3/20 0.36
MMP9 P14780 2/20 0.35
MMP8 P22894 2/20 0.35
FCER2 P06734 2/20 0.35
F10 P00742 1/20 0.35
MCHR1 Q99705 1/20 0.35
HPN P05981 1/20 0.34
ST14 Q9Y5Y6 1/20 0.34
MMP2 P08253 1/20 0.34
CTSL P07711 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
TACR1 P25103 1/20 0.34

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
SCHEMBL738034 0.93 GHSR (0.60) GHSRMC1RMC5RKLKB1KLK1
SCHEMBL737835 0.91 GHSR (0.60) GHSRMC1RMC5RKLKB1KLK1
SCHEMBL737925 0.90 GHSR (0.60) GHSRMC1RMC5RKLKB1KLK1
SCHEMBL736832 0.88 GHSR (0.60) GHSRMC1RMC5RKLKB1KLK1
SCHEMBL739069 0.83 GHSR (0.71) GHSRKLKB1KLK1MMP9MMP8
SCHEMBL738022 0.82 GHSR (0.64) GHSRKLKB1KLK1MMP9MMP8
SCHEMBL737042 0.82 GHSR (0.64) GHSRKLKB1KLK1MMP9MMP8
SCHEMBL14615567 0.81 GHSR (0.52) GHSRMC1RMC5RKLKB1KLK1
SCHEMBL739675 0.81 GHSR (0.71) GHSRKLKB1KLK1MMP9MMP8
SCHEMBL739067 0.80 GHSR (0.64) GHSRKLKB1KLK1MMP9MMP8

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
WO-2007014258-A2 GROWTH HORMONE SECRETAGOGUES SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES S.A.S. (FR) 2007-02-01 WO disclosed