SCHEMBL8990946

SCHEMBL8990946

COC(=O)NCc1ccccc1-c1ccc(CN2Cc3ccccc3C[C@@H](NC(=O)CC(C)(C)NC[C@@H](C)O)C2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.40
TACR1 P25103 1/20 0.37
MME P08473 2/20 0.36
ACE P12821 1/20 0.36
HRH4 Q9H3N8 1/20 0.35
AGTR1 P30556 1/20 0.35
OPRM1 P35372 2/20 0.35
OPRD1 P41143 1/20 0.35
KCNA5 P22460 1/20 0.33
XIAP P98170 1/20 0.33

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
SCHEMBL8990755 0.94 GHSR (0.40) GHSRTACR1MMEACEHRH4
SCHEMBL8990763 0.92 GHSR (0.42) GHSRTACR1MMEACEHRH4
SCHEMBL8991017 0.92 GHSR (0.49) GHSRTACR1MMEACEHRH4
SCHEMBL8990953 0.91 GHSR (0.51) GHSRTACR1MMEACEHRH4
SCHEMBL8990925 0.91 GHSR (0.49) GHSRTACR1MMEACEHRH4
SCHEMBL8991087 0.91 TACR1 (0.39) GHSRTACR1MMEACEHRH4
SCHEMBL8991136 0.88 GHSR (0.46) GHSRTACR1MMEACEHRH4
SCHEMBL8990801 0.87 GHSR (0.39) GHSRAGTR1KCNA5XIAP
SCHEMBL8990771 0.86 GHSR (0.42) GHSRTACR1MMEACEHRH4
SCHEMBL8990798 0.86 GHSR (0.44) GHSRTACR1KCNA5XIAP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5545735-A ANIMAL GROWTH REGULATORS MERCK & CO., INC. (US) 1996-08-13 US disclosed
WO-1995009633-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1995-04-13 WO disclosed