SCHEMBL1726248

SCHEMBL1726248

CCCCCN(CCCCC)c1ccc(Sc2ccc(N(CCCCC)CCCCC)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
CNR2 P34972 9/20 0.38
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 1/20 0.37
HSP90AA1 P07900 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34

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
SCHEMBL1459455 0.87 EGFR (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL12677177 0.85 CNR2 (0.46) EGFRERBB2CNR2
SCHEMBL1815516 0.85 CNR2 (0.46) EGFRERBB2CNR2
SCHEMBL4222294 0.83 EGFR (0.42) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4447508 0.83 EGFR (0.42) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6031457 0.82 ALDH1A1 (0.51) CNR2ALDH1A1HPGDL3MBTL1
SCHEMBL12304298 0.81 CNR2 (0.44) EGFRERBB2CNR2
SCHEMBL12304303 0.81 CNR2 (0.44) EGFRERBB2CNR2
SCHEMBL12304296 0.81 CNR2 (0.44) EGFRERBB2CNR2
SCHEMBL1128066 0.81 BDKRB2 (0.42) CHRM2CHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1755362-B1 ORGANIC EL DEVICE TOYOTA JIDOSHOKKI KK (JP) 2011-07-20 EP disclosed
US-7854998-B2 Organic EL devices KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2010-12-21 US disclosed
US-20080290788-A1 Organic el Devices KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2008-11-27 US disclosed
US-7329984-B2 Organic EL devices KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2008-02-12 US disclosed
EP-1755362-A1 ORGANIC EL DEVICE KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2007-02-21 EP disclosed
US-20060214553-A1 Organic electroluminescent device KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2006-09-28 US disclosed
US-20060125380-A1 Organic EL devices KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2006-06-15 US disclosed
EP-1670082-A2 Organic el devices Kabushiki Kaisha Toyota Jidoshokki (JP) 2006-06-14 EP disclosed
EP-1613132-A1 ORGANIC ELECTROLUMINESCENT DEVICE Kabushiki Kaisha Toyota Jidoshokki (JP) 2006-01-04 EP disclosed