SCHEMBL20104061

SCHEMBL20104061

CCN(C=O)Cc1ccoc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.45
TRPM8 Q7Z2W7 1/20 0.42
HCAR3 P49019 1/20 0.35
CETP P11597 1/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
FAAH O00519 2/20 0.33
CNR2 P34972 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
HTT P42858 1/20 0.33
CHRM2 P08172 2/20 0.32
CHRM1 P11229 2/20 0.32

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
SCHEMBL12853821 0.73 ALOX5 (0.46) ALOX5TRPM8HCAR3CETPALDH1A1
SCHEMBL968495 0.73 LMNA (0.48) ALDH1A1CNR2
SCHEMBL12853946 0.72 ALOX5 (0.53) ALOX5TRPM8HCAR3CETPALDH1A1
SCHEMBL29953793 0.71 ALOX5 (0.45) ALOX5TRPM8HCAR3CETPALDH1A1
SCHEMBL16708762 0.70 USP2 (0.42) ALDH1A1MAPTMEN1KMT2ARECQL
SCHEMBL28226951 0.70 TRPM8 (0.57) ALOX5TRPM8HCAR3CETPALDH1A1
SCHEMBL9367244 0.70
SCHEMBL13103949 0.69 TRPM8 (0.43) ALOX5TRPM8HCAR3CETPSLC1A3
SCHEMBL21392853 0.69 TRPM8 (0.52) ALOX5TRPM8HCAR3CETPALDH1A1
SCHEMBL28226280 0.69 TRPM8 (0.67) ALOX5TRPM8HCAR3CETPALDH1A1

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-3110810-B1 PYRAZOLE AMIDE DERIVATIVE TEIJIN PHARMA LTD (JP) 2018-05-02 EP disclosed