SCHEMBL809672

SCHEMBL809672

C=Cc1cc(CCCC)c(CCl)c2cc3ccccc3cc12

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
TLR7 Q9NYK1 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
ADORA3 P0DMS8 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
SCHEMBL809912 0.88 L3MBTL1 (0.34) TLR8L3MBTL1THRATHRBCYP3A4
SCHEMBL810002 0.86 L3MBTL1 (0.39) L3MBTL1CYP2C9
SCHEMBL809845 0.80 L3MBTL1 (0.40) TLR8L3MBTL1CYP2C9
SCHEMBL809707 0.77 L3MBTL1 (0.41) L3MBTL1
SCHEMBL2516586 0.76 L3MBTL1 (0.42) L3MBTL1ESR1ESR2CYP2C9
SCHEMBL810000 0.76 L3MBTL1 (0.42) L3MBTL1CYP2C9
SCHEMBL810262 0.75 L3MBTL1 (0.36) TLR8L3MBTL1
SCHEMBL809749 0.75 L3MBTL1 (0.41) L3MBTL1
SCHEMBL809812 0.74 NQO1 (0.45) L3MBTL1
SCHEMBL809642 0.73 L3MBTL1 (0.38) 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