SCHEMBL8909729

SCHEMBL8909729

CCNC(=O)c1ccccc1-c1ccc(CN2C(=O)[C@H](NC(=O)CC(C)(C)N)CCc3cccnc32)cc1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.56
AGTR1 P30556 1/20 0.56
RIPK1 Q13546 6/20 0.41
XIAP P98170 7/20 0.39
CHIA Q9BZP6 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
SCHEMBL8909721 1.00 GHSR (0.56) GHSRAGTR1RIPK1XIAPCHIA
SCHEMBL8909822 0.92 GHSR (0.60) GHSRAGTR1RIPK1XIAPCHIA
SCHEMBL8909818 0.92 GHSR (0.60) GHSRAGTR1RIPK1XIAPCHIA
SCHEMBL9025540 0.89 GHSR (0.68) GHSRAGTR1XIAP
SCHEMBL9025533 0.89 GHSR (0.68) GHSRAGTR1XIAP
SCHEMBL8910280 0.88 GHSR (0.44) GHSRAGTR1RIPK1XIAP
SCHEMBL8910284 0.88 GHSR (0.44) GHSRAGTR1RIPK1XIAP
SCHEMBL8909382 0.88 GHSR (0.44) GHSRAGTR1RIPK1XIAPCHIA
SCHEMBL8909302 0.84 GHSR (0.68) GHSRAGTR1RIPK1XIAP
SCHEMBL8909668 0.84 GHSR (0.56) GHSRAGTR1RIPK1XIAP

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
US-5606054-A Heterocyclic-fused lactams promote release of growth hormone MERCK & CO., INC. (US) 1997-02-25 US claimed
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