SCHEMBL810222

SCHEMBL810222

C=Cc1cc(CCl)ccc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.49
ALDH1A1 P00352 4/20 0.47
PPARA Q07869 2/20 0.47
PPARG P37231 1/20 0.47
PPARD Q03181 1/20 0.47
CA2 P00918 1/20 0.41
ALOX5 P09917 5/20 0.41
GABRA1 P14867 4/20 0.41
GABRB2 P47870 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 2/20 0.41
CNR2 P34972 2/20 0.41
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
PTGS1 P23219 2/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL809582 0.87 TTR (0.50) TTRALDH1A1PPARAPPARGPPARD
SCHEMBL16134881 0.84 ALDH1A1 (0.49) ALDH1A1PPARAPPARGPPARDCA2
SCHEMBL8533780 0.82 ALDH1A1 (0.50) TTRALDH1A1CA2KDM4ESMN1; SMN2
SCHEMBL22386787 0.82 ALDH1A1 (0.71) ALDH1A1PPARAPPARGPPARDALOX5
SCHEMBL31174275 0.79 ALDH1A1 (0.45) ALDH1A1PPARAPPARGPPARDALOX5
SCHEMBL18556285 0.79 ALDH1A1 (0.45) ALDH1A1PPARAPPARGPPARDCA2
SCHEMBL4877248 0.79 GABRA1 (0.60) TTRALDH1A1PPARAPPARGPPARD
SCHEMBL810068 0.79 PTGS1 (0.50) ALDH1A1ALOX5MEN1KMT2AGAA
SCHEMBL18556287 0.78 CA2 (0.50) ALDH1A1PPARAPPARGPPARDCA2
SCHEMBL185845 0.77 CA2 (0.68) TTRALDH1A1PPARAPPARGPPARD

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