SCHEMBL7791777

SCHEMBL7791777

CC(C)(NC(=O)OCc1ccccc1)C(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3CN)cc2)C1=O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.61
XIAP P98170 7/20 0.50
PTGER1 P34995 1/20 0.50
PTGER4 P35408 1/20 0.50
PTGER3 P43115 1/20 0.50
PTGER2 P43116 1/20 0.50
AGTR1 P30556 1/20 0.49
NPY1R P25929 4/20 0.47
MME P08473 1/20 0.46
ACE P12821 1/20 0.46

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
SCHEMBL7786006 0.92 GHSR (0.52) GHSRXIAPPTGER1PTGER4PTGER3
SCHEMBL8326513 0.92 GHSR (0.66) GHSRXIAPPTGER1PTGER4PTGER3
SCHEMBL7785743 0.90 GHSR (0.69) GHSRXIAPPTGER1PTGER4PTGER3
SCHEMBL9087738 0.90 GHSR (0.56) GHSRXIAPPTGER1PTGER4PTGER3
SCHEMBL8331869 0.90 GHSR (0.76) GHSRXIAPPTGER1PTGER4PTGER3
SCHEMBL8331766 0.90 GHSR (0.63) GHSRXIAPPTGER1PTGER4PTGER3
SCHEMBL8330387 0.89 GHSR (0.76) GHSRXIAPPTGER1PTGER4PTGER3
SCHEMBL8332705 0.89 GHSR (0.62) GHSRXIAPPTGER1PTGER4PTGER3
SCHEMBL8330101 0.89 GHSR (0.66) GHSRXIAPPTGER1PTGER4PTGER3
SCHEMBL8330710 0.88 GHSR (0.76) GHSRXIAPPTGER1PTGER4PTGER3

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 3 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 disclosed
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