SCHEMBL809515

SCHEMBL809515

C=Cc1ccccc1CCC(I)CCl

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL809861 0.81 ALDH1A1 (0.38) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL809373 0.80 ALDH1A1 (0.31) ALDH1A1
SCHEMBL809981 0.79 SLC6A2 (0.36) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL809890 0.78 SLC6A2 (0.36) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL810003 0.77 ALDH1A1 (0.43) ALDH1A1
SCHEMBL809637 0.77 SLC6A2 (0.34) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL810100 0.76 ALDH1A1 (0.46) ALDH1A1
SCHEMBL809443 0.76 SLC6A2 (0.40) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL595200 0.75 ALDH1A1 (0.48) ALDH1A1
SCHEMBL29377653 0.75 ALDH1A1 (0.48) ALDH1A1

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