SCHEMBL9420780

SCHEMBL9420780

CCOC(=O)N(C)C(=O)NCc1ccccc1-c1ccc(CN2C(=O)[C@H](NC(=O)C(C)(C)N)CCc3ccccc32)cc1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.74
AGTR1 P30556 1/20 0.49
XIAP P98170 10/20 0.48
PTGER1 P34995 1/20 0.41
MME P08473 1/20 0.41
ACE P12821 1/20 0.41
NPY1R P25929 2/20 0.40

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
SCHEMBL8332371 0.90 GHSR (0.81) GHSRAGTR1XIAPPTGER1MME
SCHEMBL8331994 0.87 GHSR (0.84) GHSRAGTR1XIAPPTGER1MME
SCHEMBL8330883 0.86 GHSR (0.83) GHSRAGTR1XIAPMMEACE
SCHEMBL7791986 0.86 GHSR (0.85) GHSRAGTR1XIAPMMEACE
SCHEMBL7792149 0.85 GHSR (1.00) GHSRAGTR1XIAPPTGER1MME
SCHEMBL7438263 0.85 GHSR (1.00) GHSRAGTR1XIAPMMEACE
SCHEMBL7795767 0.84 GHSR (0.77) GHSRAGTR1XIAPPTGER1MME
SCHEMBL8329924 0.84 GHSR (0.90) GHSRAGTR1XIAPPTGER1MME
SCHEMBL7792445 0.84 GHSR (0.87) GHSRAGTR1XIAPPTGER1MME
SCHEMBL8329866 0.84 GHSR (0.88) GHSRAGTR1XIAPPTGER1MME

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-1994005634-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-03-17 WO disclosed