SCHEMBL4648500

SCHEMBL4648500

Cn1ccnc1CC(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.54
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
TRPM5 Q9NZQ8 2/20 0.40
LPO P22079 1/20 0.40
MLYCD O95822 1/20 0.36
TSHR P16473 2/20 0.34
OPRK1 P41145 1/20 0.34
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.33
AOC3 Q16853 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
SCHEMBL13386387 0.86 FDPS (0.53) FDPSKMT2AMEN1TRPM5LPO
SCHEMBL4404604 0.81 FDPS (0.56) FDPSKMT2AMEN1TRPM5LPO
SCHEMBL15236207 0.80
SCHEMBL17713270 0.78 FDPS (0.53) FDPSKMT2AMEN1TRPM5LPO
SCHEMBL7154948 0.75 FDPS (0.48) FDPSKMT2AMEN1TRPM5LPO
SCHEMBL4063363 0.75 FDPS (0.48) FDPSKMT2AMEN1TRPM5LPO
SCHEMBL28993655 0.75 FDPS (0.50) FDPSKMT2AMEN1TRPM5LPO
SCHEMBL19728354 0.73 FDPS (0.49) FDPSKMT2AMEN1TRPM5LPO
SCHEMBL18160689 0.73 FDPS (0.49) FDPSKMT2AMEN1TRPM5LPO
SCHEMBL19214806 0.73 FDPS (0.49) FDPSKMT2AMEN1TRPM5LPO

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101336225-B Alkylation of n' -phenyl-n-alkylphenylenediamines in ionic liquid, n' -phenyl-n-alkyl(alkylphenylene) diamines produced thereby, and lubricant compositions containing same CHEMTURA CORP 2012-02-29 CN claimed
CN-101336224-B Ring alkylation of aniline or an aniline derivative using ionic liquid catalysts CHEMTURA CORP 2011-09-14 CN claimed
CN-101336223-B Alkylation of a diphenylamine compound in ionic liquid CHEMTURA CORP 2011-09-14 CN claimed
CN-101336224-A Ring alkylation of aniline or an aniline derivative using ionic liquid catalysts CHEMTURA CORP (US) 2008-12-31 CN claimed
CN-101336223-A Alkylation of a diphenylamine compound in ionic liquid CHEMTURA CORP (US) 2008-12-31 CN claimed
CN-101336225-A Alkylation of n' -phenyl-n-alkylphenylenediamines in ionic liquid, n' -phenyl-n-alkyl(alkylphenylene) diamines produced thereby, and lubricant compositions containing same CHEMTURA CORP (US) 2008-12-31 CN claimed
EP-1963253-A2 RING ALKYLATION OF ANILINE OR AN ANILINE DERIVATIVE USING IONIC LIQUID CATALYSTS CHEMTURA CORPORATION (US) 2008-09-03 EP claimed
EP-1960344-A1 ALKYLATION OF A DIPHENYLAMINE COMPOUND IN IONIC LIQUID CHEMTURA CORPORATION (US) 2008-08-27 EP claimed
WO-2007070264-A1 ALKYLATION OF A DIPHENYLAMINE COMPOUND IN IONIC LIQUID CHEMTURA CORPORATION (US) 2007-06-21 WO claimed
WO-2007070263-A2 RING ALKYLATION OF ANILINE OR AN ANILINE DERIVATIVE USING IONIC LIQUID CATALYSTS CHEMTURA CORPORATION (US) 2007-06-21 WO claimed
EP-2844818-A1 METHODS OF FORMING CUTTING ELEMENTS BY REMOVING METAL FROM INTERSTITIAL SPACES IN POLYCRYSTALLINE DIAMOND Baker Hughes Incorporated (US) 2015-03-11 EP disclosed
US-8716289-B2 Carbamate derivatives of alkyl-heterocycles, preparation thereof and therapeutic use thereof SANOFI (FR) 2014-05-06 US disclosed
WO-2013166398-A1 METHODS OF FORMING CUTTING ELEMENTS BY REMOVING METAL FROM INTERSTITIAL SPACES IN POLYCRYSTALLINE DIAMOND BAKER HUGHES INCORPORATED (US) 2013-11-07 WO disclosed
CN-102365816-A Electrode film for polymer actuator element, and polymer actuator element comprising same DAIKIN IND LTD 2012-02-29 CN disclosed
CN-101336225-B Alkylation of n' -phenyl-n-alkylphenylenediamines in ionic liquid, n' -phenyl-n-alkyl(alkylphenylene) diamines produced thereby, and lubricant compositions containing same CHEMTURA CORP 2012-02-29 CN disclosed
CN-101911229-A Electric double layer capacitor SHOWA DENKO KK 2010-12-08 CN disclosed
CN-101379099-A Fluorine-containing polymer containing heteroaromatic ring DAIKIN IND LTD (JP) 2009-03-04 CN disclosed
CN-101336225-A Alkylation of n' -phenyl-n-alkylphenylenediamines in ionic liquid, n' -phenyl-n-alkyl(alkylphenylene) diamines produced thereby, and lubricant compositions containing same CHEMTURA CORP (US) 2008-12-31 CN disclosed
CN-101336223-A Alkylation of a diphenylamine compound in ionic liquid CHEMTURA CORP (US) 2008-12-31 CN disclosed
CN-101336224-A Ring alkylation of aniline or an aniline derivative using ionic liquid catalysts CHEMTURA CORP (US) 2008-12-31 CN disclosed