SCHEMBL7795974

SCHEMBL7795974

C[C@@H](O)CNC(C)(C)CC(=O)N[C@@H]1CCc2cc(C(F)(F)F)ccc2N(Cc2ccc(-c3ccccc3CNC(=O)NCCO)cc2)C1=O

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.61
AGTR1 P30556 1/20 0.43
XIAP P98170 11/20 0.42
SCN9A Q15858 2/20 0.38
NPY1R P25929 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
SCHEMBL7792017 0.95 GHSR (0.60) GHSRAGTR1XIAPSCN9ANPY1R
SCHEMBL8332504 0.94 GHSR (0.61) GHSRAGTR1XIAPSCN9ANPY1R
SCHEMBL7794677 0.94 GHSR (0.60) GHSRAGTR1XIAPSCN9ANPY1R
SCHEMBL7796085 0.93 GHSR (0.63) GHSRAGTR1XIAPNPY1R
SCHEMBL7795593 0.93 GHSR (0.53) GHSRAGTR1XIAPSCN9A
SCHEMBL7791806 0.91 GHSR (0.74) GHSRAGTR1XIAPNPY1R
SCHEMBL7795556 0.90 GHSR (0.61) GHSRAGTR1XIAPNPY1R
SCHEMBL7795609 0.90 GHSR (0.61) GHSRAGTR1XIAPNPY1R
SCHEMBL7794456 0.90 GHSR (0.70) GHSRAGTR1XIAPSCN9ANPY1R
SCHEMBL7794422 0.90 GHSR (0.60) GHSRAGTR1XIAPSCN9ANPY1R

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 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