SCHEMBL810580

SCHEMBL810580

C=Cc1ccc2c(Cl)c(CCl)ccc2c1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 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
SCHEMBL809503 0.89 HTR2C (0.31) HTR2C
SCHEMBL810057 0.82 TP53 (0.34) ALDH1A1ESR1ESR2HTR2C
SCHEMBL808886 0.78 HTR2C (0.38) ALDH1A1ESR1ESR2HTR2C
SCHEMBL12431423 0.76 ESR1 (0.54) ALDH1A1ESR1ESR2
SCHEMBL21153834 0.75 ALDH1A1 (0.50) ALDH1A1ESR1ESR2HTR2C
SCHEMBL809844 0.75 HTR2C (0.33) HTR2C
SCHEMBL810172 0.74 ALDH1A1 (0.40) ALDH1A1
SCHEMBL11073040 0.74 ALDH1A1 (0.43) ALDH1A1
SCHEMBL809905 0.73 HTR2C (0.39) HTR2C
SCHEMBL809820 0.72 HTR2C (0.38) ALDH1A1HTR2C

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