SCHEMBL8909222

SCHEMBL8909222

CCNC(=O)c1ccccc1-c1ccc(CN2C(=O)[C@H](NC(=O)CC(C)(C)NC[C@H](O)CO)CCc3[nH]ccc32)cc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.43
AGTR1 P30556 1/20 0.43
XIAP P98170 10/20 0.36
AVPR1A P37288 1/20 0.32
AVPR1B P47901 1/20 0.32
NPY1R P25929 2/20 0.31

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
SCHEMBL8910322 0.94 GHSR (0.43) GHSRAGTR1XIAPAVPR1AAVPR1B
SCHEMBL8910328 0.94 GHSR (0.43) GHSRAGTR1XIAPAVPR1AAVPR1B
SCHEMBL9024424 0.89 GHSR (0.55) GHSRAGTR1XIAPNPY1R
SCHEMBL8909563 0.89 GHSR (0.45) GHSRAGTR1XIAPNPY1R
SCHEMBL8909331 0.88 GHSR (0.55) GHSRAGTR1XIAPAVPR1AAVPR1B
SCHEMBL8909325 0.88 GHSR (0.55) GHSRAGTR1XIAPAVPR1AAVPR1B
SCHEMBL9241039 0.86 GHSR (0.57) GHSRAGTR1XIAPNPY1R
SCHEMBL8909790 0.85 GHSR (0.43) GHSRAGTR1XIAPNPY1R
SCHEMBL8909323 0.84 GHSR (0.48) GHSRAGTR1XIAPNPY1R
SCHEMBL8910868 0.84 GHSR (0.59) GHSRAGTR1XIAPAVPR1AAVPR1B

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
WO-1995016692-A1 HETEROCYCLIC-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1995-06-22 WO claimed
US-5606054-A Heterocyclic-fused lactams promote release of growth hormone MERCK & CO., INC. (US) 1997-02-25 US disclosed
WO-1995016692-A1 HETEROCYCLIC-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1995-06-22 WO disclosed