SCHEMBL5512485

SCHEMBL5512485

C=CC(=O)OC(CCCC)COc1ccc(C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 8/20 0.52
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
RARB P10826 5/20 0.47
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PLA2G4A P47712 1/20 0.45
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.41

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
SCHEMBL6317041 0.95 PLA2G4B (0.56) PLA2G4BTP53TSHRRARBALDH1A1
SCHEMBL29118732 0.90 ABCB1 (0.47) PLA2G4BTSHRALDH1A1L3MBTL1MAPK1
SCHEMBL8572065 0.89 THRB (0.40) PLA2G4BTP53TSHR
SCHEMBL30337210 0.88 TP53 (0.61) PLA2G4BTP53TSHRRARBALDH1A1
SCHEMBL28256292 0.87 PLA2G4B (0.51) PLA2G4BTP53TSHRRARBALDH1A1
SCHEMBL29269217 0.86 TP53 (0.65) PLA2G4BTP53TSHRRARBALDH1A1
SCHEMBL13890821 0.85 LSS (0.47) PLA2G4BTP53TSHRRARBALDH1A1
SCHEMBL27921852 0.84 ALDH1A1 (0.53) PLA2G4BTP53TSHRRARBALDH1A1
SCHEMBL232072 0.84 THRB (0.45) PLA2G4BTSHRALDH1A1
SCHEMBL30337455 0.83 TP53 (0.58) PLA2G4BTP53TSHRRARBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007083848-A1 COMPOSITION, RETARDATION PLATE, LIQUID-CRYSTAL DISPLAY DEVICE, AND METHOD FOR PRODUCING RETARDATION PLATE FUJIFILM CORPORATION (JP) 2007-07-26 WO disclosed