SCHEMBL809422

SCHEMBL809422

C=Cc1ccc(OC)c(CCl)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.51
CYP1A2 P05177 1/20 0.41
ALDH1A1 P00352 7/20 0.40
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
TSHR P16473 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
ALOX5 P09917 1/20 0.38
GABRA1 P14867 1/20 0.38
CNR2 P34972 1/20 0.38
GABRB2 P47870 1/20 0.38
FDPS P14324 2/20 0.38
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL810086 0.86 TRPA1 (0.49) TRPA1CYP1A2ALDH1A1PPARGPPARD
SCHEMBL810242 0.86 TRPA1 (0.56) TRPA1CYP1A2ALDH1A1PPARGPPARD
SCHEMBL13348559 0.84 TRPA1 (0.53) TRPA1CYP1A2ALDH1A1PPARGPPARD
SCHEMBL810246 0.83 ALDH1A1 (0.44) TRPA1CYP1A2ALDH1A1TSHRMEN1
SCHEMBL15524138 0.82 TRPA1 (0.51) TRPA1CYP1A2ALDH1A1PPARGPPARD
SCHEMBL20861841 0.82 TRPA1 (0.51) TRPA1CYP1A2ALDH1A1PPARGPPARD
SCHEMBL810149 0.82 TRPA1 (0.51) TRPA1CYP1A2ALDH1A1PPARGPPARD
SCHEMBL29637919 0.82 ALDH1A1 (0.61) CYP1A2ALDH1A1TSHRRXFP1MEN1
SCHEMBL2241869 0.82 ALDH1A1 (0.61) CYP1A2ALDH1A1TSHRRXFP1MEN1
SCHEMBL809741 0.80 MAPT (0.47) TRPA1ALDH1A1MEN1POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017116272-A1 METHOD FOR PREPARING TERTIARY AMINES COMPRISING ETHYNYLBENZYL SUBSTITUENTS PUBLIC JOINT STOCK COMPANY "SIBUR HOLDING" (RU) 2017-07-06 WO disclosed
WO-2017116272-A1 METHOD FOR PREPARING TERTIARY AMINES COMPRISING ETHYNYLBENZYL SUBSTITUENTS PUBLIC JOINT STOCK COMPANY "SIBUR HOLDING" (RU) 2017-07-06 WO disclosed
US-9618867-B2 Pigment dispersion and toner CANON KABUSHIKI KAISHA (JP) 2017-04-11 US disclosed
US-20160246200-A1 PIGMENT DISPERSION AND TONER CANON KABUSHIKI KAISHA (JP) 2016-08-25 US disclosed
EP-2753982-B1 TONER CANON KK (JP) 2016-03-23 EP disclosed
US-9223240-B2 Toner CANON KABUSHIKI KAISHA (JP) 2015-12-29 US disclosed
US-9079989-B2 Charge control resin and manufacturing method of the same ORIENT CHEMICAL INDUSTRIES CO., LTD. (JP) 2015-07-14 US disclosed
US-20150025213-A1 CHARGE CONTROL RESIN AND MANUFACTURING METHOD OF THE SAME ORIENT CHEMICAL INDUSTRIES CO., LTD. (JP) 2015-01-22 US disclosed
US-8883946-B2 Charge control resin and manufacturing method of the same ORIENT CHEMICAL INDUSTRIES CO., LTD. (JP) 2014-11-11 US disclosed
US-20140205943-A1 TONER CANON KABUSHIKI KAISHA (JP) 2014-07-24 US disclosed
CN-103782242-A Toner CANON KK 2014-05-07 CN disclosed
US-20140080989-A1 CHARGE CONTROL RESIN AND MANUFACTURING METHOD OF THE SAME ORIENT CHEMICAL INDUSTRIES CO., LTD. (JP) 2014-03-20 US disclosed
CN-102998924-A Toner CANON KK 2013-03-27 CN disclosed
US-20130065174-A1 TONER CANON KABUSHIKI KAISHA (JP) 2013-03-14 US disclosed
WO-2013035885-A1 TONER CANON KABUSHIKI KAISHA (JP) 2013-03-14 WO disclosed
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