SCHEMBL810293

SCHEMBL810293

C=Cc1cc(OC)c2cc3cc(CCl)ccc3cc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.39
TRPA1 O75762 1/20 0.37
HTR2C P28335 1/20 0.35
NQO2 P16083 1/20 0.35
ALDH1A1 P00352 5/20 0.34
PPARG P37231 1/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
CYP3A4 P08684 3/20 0.32
ALOX5 P09917 1/20 0.32
AR P10275 1/20 0.32
PTGS1 P23219 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.32
NQO1 P15559 1/20 0.32
TUBB1 Q9H4B7 1/20 0.31
MAPT P10636 3/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL810019 0.84 PTGS1 (0.38) HTR2CALOX5PTGS1LMNAHTT
SCHEMBL810556 0.82 KDM4E (0.31) HTR2CCYP3A4CYP2C19KDM4E
SCHEMBL810249 0.81
SCHEMBL6336756 0.75 TTR (0.57) TTRALDH1A1PPARGPPARDPPARA
SCHEMBL809734 0.73 PTGS1 (0.41) HTR2CALOX5PTGS1LMNAHTT
SCHEMBL11276685 0.71 TTR (0.46) TTRALDH1A1CYP3A4PTGS1TUBB1
SCHEMBL809820 0.69 HTR2C (0.38) TRPA1HTR2CNQO2ALDH1A1TUBB1
SCHEMBL5885438 0.69 CYP1A2 (0.41) TTRHTR2CALDH1A1CYP3A4CYP1A2
SCHEMBL30443328 0.69 CYP1A2 (0.41) TTRHTR2CALDH1A1CYP3A4CYP1A2
SCHEMBL809582 0.69 TTR (0.50) TTRTRPA1ALDH1A1PPARGPPARD

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