SCHEMBL7796068

SCHEMBL7796068

COc1ccc2c(c1)SC[C@@H](NC(=O)CC(C)(C)NC[C@@H](C)O)C(=O)N2Cc1ccc(-c2ccccc2CNC(N)=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.43
XIAP P98170 4/20 0.37
AGTR1 P30556 1/20 0.37
F7 P08709 7/20 0.34
F3 P13726 7/20 0.34
F2 P00734 3/20 0.34
MLNR O43193 1/20 0.33
KCNA5 P22460 1/20 0.33
KCNH2 Q12809 1/20 0.33
F10 P00742 3/20 0.32
HTR7 P34969 1/20 0.32

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
SCHEMBL8331855 0.94 GHSR (0.43) GHSRXIAPAGTR1F7F3
SCHEMBL7794630 0.93 GHSR (0.49) GHSRXIAPAGTR1F7F3
SCHEMBL7795833 0.93 GHSR (0.50) GHSRXIAPAGTR1F7F3
SCHEMBL7785931 0.93 GHSR (0.51) GHSRXIAPAGTR1MLNRKCNA5
SCHEMBL7794434 0.91 GHSR (0.44) GHSRXIAPAGTR1F7F3
SCHEMBL7796091 0.91 GHSR (0.48) GHSRXIAPAGTR1F7F3
SCHEMBL7792068 0.91 GHSR (0.44) GHSRXIAPAGTR1F7F3
SCHEMBL7791796 0.90 GHSR (0.47) GHSRXIAPAGTR1F7F3
SCHEMBL7791802 0.90 GHSR (0.43) GHSRXIAPAGTR1F7F3
SCHEMBL9102792 0.89 GHSR (0.42) 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 7 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
WO-1994005634-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-03-17 WO disclosed