SCHEMBL5329798

SCHEMBL5329798

C=CCc1ccc(C(=O)O)c(S(=O)(=O)O)c1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.36
POLB P06746 2/20 0.36
ALOX15 P16050 1/20 0.32
PTGDR Q13258 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MAPT P10636 1/20 0.31
CYP1A2 P05177 1/20 0.31
GABRA1 P14867 2/20 0.30
GABRB2 P47870 2/20 0.30
MCL1 Q07820 1/20 0.30
GAA P10253 1/20 0.30
TSHR P16473 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
SCHEMBL9285041 0.88 CYP2D6 (0.36) CYP2D6POLBPTGDRPTGDR2ALDH1A1
SCHEMBL28181980 0.86 CYP2D6 (0.33) CYP2D6
SCHEMBL8099247 0.81 ALOX15 (0.39) CYP2D6ALOX15ALDH1A1KDM4EHPGD
SCHEMBL27835976 0.80 CYP1A2 (0.37) POLBALOX15PTGDRPTGDR2ALDH1A1
SCHEMBL27515375 0.80 ALOX15 (0.42) CYP2D6POLBALOX15ALDH1A1KDM4E
SCHEMBL9280152 0.79 CYP2D6 (0.35) CYP2D6POLBPTGDRPTGDR2KDM4E
SCHEMBL243841 0.78 GAA (0.38) POLBPTGDRPTGDR2ALDH1A1KDM4E
SCHEMBL8816524 0.78 SELL (0.41) POLBPTGDRPTGDR2ALDH1A1KDM4E
SCHEMBL278362 0.77 CYP2D6 (0.35) CYP2D6POLBPTGDRPTGDR2KDM4E
SCHEMBL28380141 0.77 CYP2D6 (0.35) CYP2D6POLBPTGDRPTGDR2KDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070148423-A1 Biaxially stretched laminated polyester film and polyester film for covering MITSUBISHI POLYESTER FILM CORPORATION (JP) 2007-06-28 US disclosed
US-20060073317-A1 Biaxially stretched laminated polyester film and polyester film for covering MITSUBISHI POLYESTER FILM CORPORATION (JP) 2006-04-06 US disclosed
EP-1598182-A1 BIAXIALLY ORIENTED LAMINATED POLYESTER FILM AND POLYESTER FILM FOR LID MATERIAL Mitsubishi Polyester Film Corporation (JP) 2005-11-23 EP disclosed