SCHEMBL8328299

SCHEMBL8328299

COc1ccccc1NC(=O)NCc1ccccc1-c1ccc(CN2C(=O)[C@H](NC(=O)C(C)(C)N)CCc3ccccc32)cc1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.78
AGTR1 P30556 1/20 0.51
XIAP P98170 14/20 0.50
NPY1R P25929 1/20 0.43

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
SCHEMBL8330469 0.91 GHSR (0.81) GHSRAGTR1XIAPNPY1R
SCHEMBL7792071 0.90 GHSR (0.63) GHSRAGTR1XIAP
SCHEMBL8331014 0.89 GHSR (0.61) GHSRAGTR1XIAPNPY1R
SCHEMBL8330883 0.88 GHSR (0.83) GHSRAGTR1XIAPNPY1R
SCHEMBL7438263 0.88 GHSR (1.00) GHSRAGTR1XIAPNPY1R
SCHEMBL7792149 0.87 GHSR (1.00) GHSRAGTR1XIAPNPY1R
SCHEMBL8329866 0.87 GHSR (0.88) GHSRAGTR1XIAPNPY1R
SCHEMBL7792445 0.87 GHSR (0.87) GHSRAGTR1XIAPNPY1R
SCHEMBL7794452 0.86 GHSR (1.00) GHSRAGTR1XIAPNPY1R
SCHEMBL7791986 0.86 GHSR (0.85) GHSRAGTR1XIAPNPY1R

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-5968924-A HAVE THE ABILITY TO STIMULATE THE RELEASE OF NATURAL OR ENDOGENOUS GROWTH HORMONE; TREATMENT OF OBESITY, OSTEOPOROSIS MERCK & CO., INC. (US) 1999-10-19 US disclosed
WO-1994005634-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-03-17 WO disclosed