SCHEMBL8328852

SCHEMBL8328852

CC(C)(C)OC(=O)NC(C)(C)C(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3CNC(=O)OCc3ccccc3)cc2)C1=O

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.63
NPY1R P25929 2/20 0.51
XIAP P98170 5/20 0.49
PTGER1 P34995 1/20 0.47
PTGER4 P35408 1/20 0.47
PTGER3 P43115 1/20 0.47
PTGER2 P43116 1/20 0.47
SCN9A Q15858 3/20 0.46
AGTR1 P30556 1/20 0.45
MME P08473 1/20 0.44
ACE P12821 1/20 0.44

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
SCHEMBL8331766 0.97 GHSR (0.63) GHSRNPY1RXIAPPTGER1PTGER4
SCHEMBL7794388 0.93 GHSR (0.64) GHSRNPY1RXIAPPTGER1PTGER4
SCHEMBL7794392 0.93 GHSR (0.64) GHSRNPY1RXIAPPTGER1PTGER4
SCHEMBL8333075 0.92 GHSR (0.67) GHSRNPY1RXIAPSCN9AAGTR1
SCHEMBL8326513 0.91 GHSR (0.66) GHSRNPY1RXIAPPTGER1PTGER4
SCHEMBL7785743 0.91 GHSR (0.69) GHSRNPY1RXIAPPTGER1PTGER4
SCHEMBL8331869 0.91 GHSR (0.76) GHSRNPY1RXIAPPTGER1PTGER4
SCHEMBL7795767 0.90 GHSR (0.77) GHSRNPY1RXIAPPTGER1PTGER4
SCHEMBL8330101 0.90 GHSR (0.66) GHSRNPY1RXIAPPTGER1PTGER4
SCHEMBL8330387 0.90 GHSR (0.76) GHSRNPY1RXIAPPTGER1PTGER4

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 2 patents. 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
WO-1994005634-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-03-17 WO disclosed