SCHEMBL9038320

SCHEMBL9038320

C[C@@H](O)CNC(C)(C)CC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccsc3-c3nnn[nH]3)cc2)C1=O

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.55
AGTR1 P30556 1/20 0.55
XIAP P98170 12/20 0.45
NPY1R P25929 2/20 0.41

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
L-692585 SCHEMBL9024978 0.91 GHSR (0.60) GHSRAGTR1XIAP
L-692585 SCHEMBL9025213 0.91 GHSR (0.60) GHSRAGTR1XIAP
L-692585 SCHEMBL7474014 0.91 GHSR (0.60) GHSRAGTR1XIAP
SCHEMBL1388282 0.90 GHSR (0.68) GHSRAGTR1XIAPNPY1R
SCHEMBL9694520 0.87 GHSR (0.53) GHSRAGTR1XIAPNPY1R
SCHEMBL8908983 0.87 GHSR (0.52) GHSRAGTR1XIAPNPY1R
SCHEMBL9025440 0.86 GHSR (0.61) GHSRAGTR1XIAPNPY1R
SCHEMBL1388243 0.86 GHSR (0.59) GHSRAGTR1XIAPNPY1R
SCHEMBL9025110 0.86 GHSR (0.59) GHSRAGTR1XIAPNPY1R
SCHEMBL9025740 0.86 GHSR (0.59) GHSRAGTR1XIAPNPY1R

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0682654-A4 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE. MERCK & CO INC (US) 1996-01-17 EP disclosed
EP-0682654-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO. INC. (US) 1995-11-22 EP disclosed
WO-1994018169-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-08-18 WO disclosed
US-5284841-A Benzo-fused lactams promote release of growth hormone MERCK & CO., INC. (US) 1994-02-08 US disclosed