SCHEMBL810556

SCHEMBL810556

C=Cc1cc(C)c2cc3cc(CCl)ccc3cc2c1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
HTR2C P28335 1/20 0.30

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
SCHEMBL810249 0.84
SCHEMBL810293 0.82 TTR (0.39) KDM4ECYP3A4CYP2C19HTR2C
SCHEMBL810019 0.77 PTGS1 (0.38) HTR2C
SCHEMBL30443328 0.72 CYP1A2 (0.41) CYP3A4HIF1AHTR2C
SCHEMBL5885438 0.72 CYP1A2 (0.41) CYP3A4HIF1AHTR2C
SCHEMBL809844 0.70 HTR2C (0.33) HTR2C
SCHEMBL5885608 0.68 CYP1A2 (0.44) HTR2C
SCHEMBL30872875 0.68 CYP1A2 (0.44) HTR2C
SCHEMBL4574912 0.66 CYP2A6 (0.52) CYP3A4HIF1AHTR2C
SCHEMBL30443467 0.66 CYP1A2 (0.42) HTR2C

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