SCHEMBL7429966

SCHEMBL7429966

C1CCC1.CCNc1nc(C)nc2c1CCC(=O)N2c1c(C)cc(Br)cc1C

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
PGK1 P00558 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
SCHEMBL7440014 0.84
SCHEMBL7429959 0.79 CRHR1 (0.38) ALDH1A1
SCHEMBL5600248 0.75 CRHR1 (0.34)
SCHEMBL7436852 0.75 CRHR1 (0.33) ALDH1A1
SCHEMBL5600475 0.74 CRHR1 (0.46)
SCHEMBL7437676 0.70 CRHR1 (0.45) ALDH1A1
SCHEMBL5599574 0.70 CRHR1 (0.39) ALDH1A1GAA
SCHEMBL5843381 0.69 CRHR1 (0.34) ALDH1A1
SCHEMBL6053053 0.69 CRHR1 (0.39) ALDH1A1
SCHEMBL5600350 0.67 CRHR1 (0.41)

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-1149583-A2 Combinations of corticotropin releasing factor antagonists and growth hormone secretagogues Pfizer Products Inc. (US) 2001-10-31 EP claimed