SCHEMBL1505897

SCHEMBL1505897

O=C(c1ccccc1)c1cccc(F)c1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.53
AKR1C3 P42330 1/20 0.50
ATM Q13315 2/20 0.49
CDC25B P30305 1/20 0.49
GAA P10253 2/20 0.47
MAPT P10636 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 3/20 0.46
ADORA1 P30542 1/20 0.45
NR1H2 P55055 1/20 0.45
NR1H3 Q13133 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
ALB P02768 1/20 0.43
PDE4A P27815 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL934810 0.87 AKR1C3 (0.59) AKR1C3ATMCDC25BGAAMAPT
SCHEMBL28150484 0.81 AKR1C3 (0.64) AKR1C3ATMCDC25BGAAMAPT
SCHEMBL333008 0.81 AKR1C3 (0.61) TTRAKR1C3ATMCDC25BGAA
SCHEMBL29433447 0.81 AKR1C3 (0.61) TTRAKR1C3ATMCDC25BGAA
SCHEMBL2333980 0.80 ALDH1A1 (0.56) AKR1C3ATMCDC25BGAAMAPT
SCHEMBL92724 0.80 AKR1C3 (0.52) AKR1C3ATMCDC25BGAAMAPT
SCHEMBL9306455 0.80 ALDH1A1 (0.62) TTRGAAMAPTMEN1KMT2A
SCHEMBL30618783 0.80 ALDH1A1 (0.56) AKR1C3ATMCDC25BGAAMAPT
SCHEMBL29350930 0.79 CES2 (0.61) AKR1C3ATMCDC25BGAAMAPT
SCHEMBL809731 0.79 CES2 (0.61) AKR1C3ATMCDC25BGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101575417-B Proton conductive polymer electrolytes and fuel cells GM GLOBAL TECH OPERATIONS INC 2015-02-11 CN disclosed
US-7897693-B2 Proton conductive polymer electrolytes and fuel cells GM GLOBAL TECHNOLOGY OPERATIONS, INC. (US) 2011-03-01 US disclosed
US-20090281262-A1 PROTON CONDUCTIVE POLYMER ELECTROLYTES AND FUEL CELLS GM GLOBAL TECHNOLOGY OPERATIONS, INC. (US) 2009-11-12 US disclosed
CN-101575417-A Proton conductive polymer electrolytes and fuel cells GM GLOBAL TECH OPERATIONS INC (US) 2009-11-11 CN disclosed