SCHEMBL7794457

SCHEMBL7794457

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

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.57
XIAP P98170 2/20 0.46
AGTR1 P30556 1/20 0.39
F7 P08709 2/20 0.39
F3 P13726 2/20 0.39
F2 P00734 1/20 0.39
ACE P12821 4/20 0.39
MME P08473 3/20 0.39
PTGER1 P34995 1/20 0.38
PTGER4 P35408 1/20 0.38
PTGER3 P43115 1/20 0.38
PTGER2 P43116 1/20 0.38
SRC P12931 1/20 0.37

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
SCHEMBL7791878 0.92 GHSR (0.49) GHSRXIAPAGTR1F7F3
SCHEMBL7786108 0.90 XIAP (0.47) GHSRXIAPAGTR1F7F3
SCHEMBL7785970 0.88 XIAP (0.46) GHSRXIAPAGTR1F7F3
SCHEMBL7795532 0.87 GHSR (0.61) GHSRXIAPAGTR1F7F3
SCHEMBL7792002 0.87 GHSR (0.75) GHSRXIAPAGTR1F7F3
SCHEMBL7796090 0.86 GHSR (0.76) GHSRXIAPAGTR1ACEMME
SCHEMBL7791803 0.85 XIAP (0.44) GHSRXIAPAGTR1F7F3
SCHEMBL7795973 0.85 GHSR (0.63) GHSRXIAPAGTR1F7F3
SCHEMBL7795736 0.85 XIAP (0.42) GHSRXIAPAGTR1F7F3
SCHEMBL8330629 0.83 GHSR (0.75) GHSRXIAPAGTR1F7F3

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 6 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
EP-0659179-A4 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE. MERCK & CO INC (US) 1995-08-09 EP claimed
EP-0659179-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO. INC. (US) 1995-06-28 EP 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