SCHEMBL809953

SCHEMBL809953

C=Cc1ccc(CCl)c2cc3c(OC)cccc3cc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NQO1 P15559 1/20 0.37
NQO2 P16083 2/20 0.31
PDE10A Q9Y233 2/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
CYP1A2 P05177 2/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
CA12 O43570 1/20 0.31
PDGFRB P09619 2/20 0.31
RXRA P19793 1/20 0.31
EGFR P00533 1/20 0.31
KDR P35968 1/20 0.31
PDGFRA P16234 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
CYP3A4 P08684 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
SCHEMBL810046 0.84 MAPT (0.35) KDM4EALDH1A1HPGDPDE10AACHE
SCHEMBL810291 0.83 CYP1A2 (0.40) ALDH1A1HPGDHSD17B10CYP1A2L3MBTL1
SCHEMBL809771 0.81 ALDH1A1 (0.36) ALDH1A1CYP1A2L3MBTL1
SCHEMBL3623450 0.80 NQO1 (0.48) KDM4EALDH1A1HPGDHSD17B10NQO1
SCHEMBL810223 0.80 L3MBTL1 (0.30) L3MBTL1
SCHEMBL3628368 0.78 NQO1 (0.46) KDM4EALDH1A1HPGDHSD17B10NQO1
SCHEMBL810201 0.72 DYRK1A (0.43) KDM4EALDH1A1HSD17B10CYP1A2CYP1A1
SCHEMBL29919905 0.72 NQO1 (0.67) KDM4EALDH1A1HPGDHSD17B10NQO1
SCHEMBL8393507 0.72 NQO1 (0.67) KDM4EALDH1A1HPGDHSD17B10NQO1
SCHEMBL809812 0.70 NQO1 (0.45) KDM4EALDH1A1HPGDNQO1NQO2

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
WO-2012015977-A3 HIGHLY PORTABLE AND STABLE WORK STATION HERSCHLER MATTHEW B (US) 2012-05-10 WO disclosed
EP-2192645-B1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME TOKUYAMA CORP (JP) 2011-11-30 EP disclosed
US-20110250525-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME TOKUYAMA CORPORATION (JP) 2011-10-13 US disclosed
EP-2192645-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME Tokuyama Corporation (JP) 2010-06-02 EP disclosed