SCHEMBL810274

SCHEMBL810274

C=Cc1ccccc1CC(I)CC

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.31
TRPA1 O75762 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
SCHEMBL5034595 0.81 ALDH1A1 (0.38) ALDH1A1LMNATRPA1
SCHEMBL7056363 0.80 ALDH1A1 (0.36) ALDH1A1LMNATRPA1
SCHEMBL5033204 0.80 ALDH1A1 (0.36) ALDH1A1LMNATRPA1
SCHEMBL810129 0.79 ALDH1A1 (0.39) ALDH1A1LMNATRPA1
SCHEMBL30641415 0.77 GABRA1 (0.47) ALDH1A1LMNA
SCHEMBL535990 0.77 GABRA1 (0.47) ALDH1A1LMNA
SCHEMBL24807582 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL6285947 0.76 ALDH1A1 (0.33) ALDH1A1
SCHEMBL30104455 0.76 ALDH1A1 (0.33) ALDH1A1
SCHEMBL6025866 0.76 ALDH1A1 (0.39) ALDH1A1LMNATRPA1

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