SCHEMBL6162877

SCHEMBL6162877

CC(=O)NCC1(c2ccccc2)CCN(C(=O)[C@@H](COCc2ccccc2)NC(=O)C(C)(C)NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.46
TACR1 P25103 4/20 0.46
CTSS P25774 1/20 0.44
PPARA Q07869 2/20 0.44
PPARG P37231 1/20 0.41
UGCG Q16739 2/20 0.40
CYP3A4 P08684 1/20 0.40
KLK7 P49862 2/20 0.39
KLK5 Q9Y337 2/20 0.39
KMT2A Q03164 1/20 0.37

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
SCHEMBL6164692 0.87 GHSR (0.48) GHSRTACR1CTSSPPARAPPARG
SCHEMBL6164689 0.87 GHSR (0.48) GHSRTACR1CTSSPPARAPPARG
SCHEMBL27477229 0.87 GHSR (0.59) GHSRTACR1UGCGCYP3A4
SCHEMBL6159936 0.87 GHSR (0.59) GHSRTACR1UGCGCYP3A4
SCHEMBL6162874 0.85 GHSR (0.48) GHSRTACR1CTSSPPARAPPARG
SCHEMBL6163155 0.83 GHSR (0.46) GHSRCTSSPPARAPPARGUGCG
SCHEMBL6164012 0.81 GHSR (0.45) GHSRTACR1CTSSPPARAPPARG
SCHEMBL6164007 0.81 GHSR (0.45) GHSRTACR1CTSSPPARAPPARG
SCHEMBL6162072 0.81 GHSR (0.46) GHSRTACR1CTSSPPARAPPARG
SCHEMBL6162074 0.81 GHSR (0.46) GHSRTACR1CTSSPPARAPPARG

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
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed