SCHEMBL8329751

SCHEMBL8329751

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

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.60
AGTR1 P30556 1/20 0.52
XIAP P98170 14/20 0.51

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
SCHEMBL9181028 0.95 GHSR (0.59) GHSRAGTR1XIAP
SCHEMBL8332556 0.94 GHSR (0.60) GHSRAGTR1XIAP
SCHEMBL9024855 0.93 GHSR (0.62) GHSRAGTR1XIAP
SCHEMBL7791590 0.92 GHSR (0.63) GHSRAGTR1XIAP
SCHEMBL7795991 0.92 GHSR (0.72) GHSRAGTR1XIAP
SCHEMBL7791806 0.91 GHSR (0.74) GHSRAGTR1XIAP
SCHEMBL7786018 0.91 GHSR (0.72) GHSRAGTR1XIAP
SCHEMBL9024928 0.91 GHSR (0.60) GHSRAGTR1XIAP
SCHEMBL9024337 0.91 GHSR (0.58) GHSRAGTR1XIAP
SCHEMBL9025207 0.89 GHSR (0.58) GHSRAGTR1XIAP

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
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