SCHEMBL9694552

SCHEMBL9694552

CC(C)(N)CC(=O)NC1Sc2ccccc2CN(Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)C1=O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.48
AGTR1 P30556 2/20 0.48
HDAC1 Q13547 2/20 0.32
HDAC7 Q8WUI4 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL8990860 1.00 GHSR (0.48) GHSRAGTR1HDAC1HDAC7MEN1
SCHEMBL8990919 0.92 GHSR (0.40) GHSRAGTR1HDAC1HDAC7MEN1
SCHEMBL8990823 0.90 AGTR1 (0.42) GHSRAGTR1
SCHEMBL8990937 0.88 AGTR1 (0.38) GHSRAGTR1
SCHEMBL8990854 0.86 GHSR (0.52) GHSRAGTR1
SCHEMBL9024772 0.86 GHSR (0.52) GHSRAGTR1HDAC1HDAC7
SCHEMBL8990884 0.83 GHSR (0.36) GHSRAGTR1
SCHEMBL8990849 0.81 GHSR (0.42) GHSRAGTR1HDAC1HDAC7MEN1
SCHEMBL8990903 0.81 AGTR1 (0.34) GHSRAGTR1
SCHEMBL8990986 0.80 AGTR1 (0.47) GHSRAGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0513974-A1 Novel benzo-fused lactams that promote the release of growth hormone MERCK & CO. INC. (US) 1992-11-19 EP disclosed