SCHEMBL8717060

SCHEMBL8717060

CC(C)(N)CC(=O)NC1CCc2c(ccc3ccccc23)N(Cc2ccc(-c3ccccc3)c(-c3nnn[nH]3)c2)C1=O

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.54
AGTR1 P30556 1/20 0.54
XIAP P98170 10/20 0.39
NPY1R P25929 2/20 0.34

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
SCHEMBL8523099 0.93 GHSR (0.61) GHSRAGTR1XIAP
SCHEMBL14977965 0.93 GHSR (0.61) GHSRAGTR1XIAP
Trifluoroacetic Acid SCHEMBL8716938 0.90 GHSR (0.57) GHSRAGTR1XIAP
SCHEMBL9405635 0.88 GHSR (0.67) GHSRAGTR1XIAPNPY1R
SCHEMBL8523460 0.82 AGTR1 (0.53) GHSRAGTR1XIAPNPY1R
Hydrochloric Acid SCHEMBL8714288 0.81 AGTR1 (0.52) GHSRAGTR1XIAPNPY1R
SCHEMBL9025202 0.81 GHSR (0.62) GHSRAGTR1XIAPNPY1R
SCHEMBL9024318 0.81 GHSR (0.62) GHSRAGTR1XIAPNPY1R
SCHEMBL9024158 0.80 GHSR (0.66) GHSRAGTR1XIAPNPY1R
SCHEMBL9024548 0.80 GHSR (0.66) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5817654-A STIMULATE GROWTH HORMONES NOVO NORDISK A/S (DK) 1998-10-06 US claimed