SCHEMBL3216263

SCHEMBL3216263

[C]1C=CC(c2ccccc2)C=C1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.34
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
MAOB P27338 8/20 0.32
MAOA P21397 7/20 0.32
KDM1A O60341 5/20 0.32
CYP2C19 P33261 4/20 0.32
CYP2B6 P20813 3/20 0.32
CYP1A2 P05177 3/20 0.32
LMNA P02545 3/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP3A4 P08684 2/20 0.32
TAAR1 Q96RJ0 2/20 0.32
HTR2C P28335 2/20 0.32
HTR1A P08908 1/20 0.32
ADRA2A P08913 1/20 0.32
CYP2A6 P11509 1/20 0.32
SLC6A2 P23975 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
SCHEMBL4356377 0.80 RECQL (0.42) RECQLMAPTTSHRMAOBMAOA
SCHEMBL7774927 0.75 RECQL (0.39) RECQLMAPTTSHRMAOBMAOA
SCHEMBL11320221 0.72 RECQL (0.37) RECQLMAPTTSHRMAOBMAOA
Methylamine SCHEMBL4256041 0.72 CYP1A2 (0.44) RECQLMAPTGAAMAOBMAOA
SCHEMBL3740188 0.68 RECQL (0.39) RECQLTSHRMAOBMAOAKDM1A
SCHEMBL503332 0.68 RECQL (0.34) RECQLGAATSHRMAOBMAOA
SCHEMBL3002753 0.67 TSHR (0.41) RECQLMAPTTSHRMAOBMAOA
SCHEMBL27545087 0.67 RECQL (0.37) RECQLMAPTTSHRMAOBMAOA
SCHEMBL15647069 0.67 TSHR (0.35) RECQLMAPTTSHRMAOBMAOA
SCHEMBL2271220 0.67 ALDH1A1 (0.35) RECQLTSHRMAOBMAOAKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795801-B2 Organic electroluminescent element, illuminator, display and compound KONICA MINOLTA HOLDINGS, INC. (JP) 2010-09-14 US disclosed
EP-1679940-A1 ORGANIC ELECTROLUMINESCENT DEVICE, ILLUMINATING DEVICE, AND DISPLAY KONICA MINOLTA HOLDINGS, INC. (JP) 2006-07-12 EP disclosed
US-20050069729-A1 Organic electroluminescent element, illuminator, display and compound KONICA MINOLTA HOLDINGS, INC. (JP) 2005-03-31 US disclosed