SCHEMBL809812

SCHEMBL809812

C=Cc1cc(OC)c(CCl)c2cc3ccccc3cc12

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 3/20 0.36
TTR P02766 1/20 0.35
PDE10A Q9Y233 3/20 0.34
NQO2 P16083 1/20 0.34
TP53 P04637 1/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.33
CETP P11597 1/20 0.32
CYP1A2 P05177 2/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
CYP2A6 P11509 1/20 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
SCHEMBL809871 0.87 L3MBTL1 (0.37) NQO1L3MBTL1MAPTTTRALDH1A1
SCHEMBL810262 0.86 L3MBTL1 (0.36) NQO1L3MBTL1MAPTTP53ALDH1A1
SCHEMBL809665 0.83 KMT2A (0.36) L3MBTL1MAPTTP53ALDH1A1HPGD
SCHEMBL809845 0.83 L3MBTL1 (0.40) L3MBTL1CYP1A2
SCHEMBL809707 0.81 L3MBTL1 (0.41) NQO1L3MBTL1MAPTALDH1A1CYP1A2
SCHEMBL810000 0.79 L3MBTL1 (0.42) L3MBTL1MAPTALDH1A1CYP1A2
SCHEMBL2516586 0.79 L3MBTL1 (0.42) L3MBTL1MAPTALDH1A1CYP1A2
SCHEMBL810002 0.78 L3MBTL1 (0.39) L3MBTL1MAPTALDH1A1CYP1A2CYP2A6
SCHEMBL809749 0.78 L3MBTL1 (0.41) L3MBTL1ALDH1A1
SCHEMBL809672 0.74 TLR8 (0.36) L3MBTL1

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