SCHEMBL8330104

SCHEMBL8330104

CNC(=O)Nc1ccccc1Oc1ccccc1-c1ccc(CN2C(=O)[C@H](NC(=O)CC(C)(C)NC(=O)OC(C)(C)C)CCc3ccccc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.53
AGTR1 P30556 1/20 0.53
NPY1R P25929 3/20 0.50
XIAP P98170 6/20 0.48
CCKBR P32239 2/20 0.46
SCN9A Q15858 2/20 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
SCHEMBL7785742 0.95 GHSR (0.56) GHSRAGTR1NPY1RXIAPCCKBR
SCHEMBL8334390 0.91 NPY1R (0.54) GHSRAGTR1NPY1RXIAPCCKBR
SCHEMBL7792318 0.90 GHSR (0.65) GHSRAGTR1NPY1RXIAPCCKBR
SCHEMBL7792865 0.88 GHSR (0.55) GHSRAGTR1NPY1RXIAPCCKBR
SCHEMBL8330441 0.88 GHSR (0.52) GHSRAGTR1NPY1RXIAPCCKBR
SCHEMBL7795426 0.88 GHSR (0.57) GHSRAGTR1NPY1RXIAPCCKBR
SCHEMBL7794013 0.88 GHSR (0.55) GHSRAGTR1NPY1RXIAPCCKBR
SCHEMBL7791688 0.88 GHSR (0.56) GHSRAGTR1NPY1RXIAPCCKBR
SCHEMBL7785738 0.87 NPY1R (0.52) GHSRAGTR1NPY1RXIAP
SCHEMBL8327773 0.87 GHSR (0.52) GHSRAGTR1NPY1RXIAPCCKBR

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
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
US-5283241-A Animal growth regulators MERCK & CO., INC. (US) 1994-02-01 US disclosed