SCHEMBL3375288

SCHEMBL3375288

Cn1c(=O)ccc2ncc(F)c(CBr)c21

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.31
PIK3CA P42336 1/20 0.31
TRPA1 O75762 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL13425000 0.87 USP2 (0.33) DPP4PIK3CATRPA1GAAMAPT
SCHEMBL3378607 0.85 KCNH2 (0.31) DPP4PIK3CATRPA1GAAMAPT
SCHEMBL30366404 0.83
SCHEMBL21820230 0.83
SCHEMBL21820317 0.82 NCOA1 (0.33)
SCHEMBL30236867 0.82 NCOA1 (0.33)
SCHEMBL21820321 0.81
SCHEMBL21820265 0.81 TTR (0.32) PIK3CA
SCHEMBL30236725 0.81
SCHEMBL3375679 0.80 L3MBTL1 (0.33) PIK3CAGAAMAPTHTTL3MBTL1

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
WO-2010046388-A1 SUBSTITUTED (AZA) -1-METHYL-1H-QUINOLIN-2-ONES AS ANTIBACTERIALS GLAXO GROUP LIMITED (GB) 2010-04-29 WO disclosed