SCHEMBL7791803

SCHEMBL7791803

CNC(=O)OCc1ccccc1-c1ccc(CN2C(=O)[C@H](NC(=O)CC(C)(C)NC[C@@H](C)O)CSc3ccccc32)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
XIAP P98170 4/20 0.44
GHSR Q92847 4/20 0.42
AGTR1 P30556 1/20 0.39
MME P08473 3/20 0.36
ACE P12821 3/20 0.36
F7 P08709 2/20 0.35
F3 P13726 2/20 0.35
F2 P00734 1/20 0.35
SRC P12931 2/20 0.34

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
SCHEMBL7795736 0.94 XIAP (0.42) XIAPGHSRAGTR1MMEACE
SCHEMBL7791878 0.89 GHSR (0.49) XIAPGHSRAGTR1MMEACE
SCHEMBL7795613 0.89 GHSR (0.56) XIAPGHSRAGTR1MMEACE
SCHEMBL7795570 0.89 GHSR (0.46) XIAPGHSRAGTR1MMEACE
SCHEMBL9267051 0.87 GHSR (0.45) XIAPGHSRAGTR1MMEACE
SCHEMBL7791892 0.87 GHSR (0.56) XIAPGHSRAGTR1
SCHEMBL7796091 0.86 GHSR (0.48) XIAPGHSRAGTR1MMEACE
SCHEMBL7786108 0.86 XIAP (0.47) XIAPGHSRAGTR1MMEACE
SCHEMBL7794433 0.86 XIAP (0.47) XIAPGHSRAGTR1MMEACE
SCHEMBL7785962 0.85 GHSR (0.57) XIAPGHSRAGTR1MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0659179-B1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO INC (US) 2001-11-21 EP claimed
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 claimed
WO-1994005634-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-03-17 WO claimed
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