SCHEMBL9688995

SCHEMBL9688995

O=C1c2ccccc2C(=O)N1OCC(F)(F)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.53
ALDH1A1 P00352 5/20 0.50
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
CYP1A2 P05177 2/20 0.46
MAPT P10636 2/20 0.46
CYP2C9 P11712 1/20 0.46
ATM Q13315 1/20 0.44
HTT P42858 1/20 0.43
RECQL P46063 1/20 0.42
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
MASP2 O00187 1/20 0.37
F2 P00734 1/20 0.37

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
SCHEMBL29739823 0.85 GAA (0.56) GAAALDH1A1KMT2AMEN1CYP1A2
SCHEMBL3568366 0.85 GAA (0.56) GAAALDH1A1KMT2AMEN1CYP1A2
Methyl Alcohol SCHEMBL28761646 0.81 GAA (0.51) GAAALDH1A1KMT2AMEN1CYP1A2
SCHEMBL18026637 0.78 GAA (0.56) GAAALDH1A1KMT2AMEN1CYP1A2
SCHEMBL13545621 0.76 GAA (0.69) GAAALDH1A1KMT2AMEN1CYP1A2
SCHEMBL527771 0.76 GAA (0.58) GAAALDH1A1KMT2AMEN1CYP1A2
SCHEMBL30375313 0.75 GAA (0.53) GAAALDH1A1KMT2AMEN1CYP1A2
SCHEMBL31712162 0.75 GAA (0.62) GAAALDH1A1KMT2AMEN1CYP1A2
SCHEMBL2570420 0.75 GAA (0.53) GAAALDH1A1KMT2AMEN1CYP1A2
SCHEMBL7475276 0.75 GAA (0.62) GAAALDH1A1KMT2AMEN1CYP1A2

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
EP-0517041-A1 New Cephem Compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-12-09 EP disclosed