SCHEMBL3266344

SCHEMBL3266344

CC(F)c1ccccc1.COc1ccc(CF)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.50
KMT2A Q03164 4/20 0.48
MEN1 O00255 2/20 0.48
TDP1 Q9NUW8 2/20 0.47
ALDH1A1 P00352 3/20 0.46
EPHX1 P07099 1/20 0.43
SLC6A4 P31645 1/20 0.43
CASR P41180 1/20 0.43
MITF O75030 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
SIGMAR1 Q99720 1/20 0.42
ACP3 P15309 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL1895592 0.80 IDO1 (0.58) LTA4HALDH1A1SLC6A4MAPT
SCHEMBL22417397 0.78 CA1 (0.55) KMT2AMEN1TDP1ALDH1A1SLC6A4
SCHEMBL4603241 0.74 MEN1 (0.59) LTA4HKMT2AMEN1ALDH1A1SLC6A4
SCHEMBL4603238 0.74 MEN1 (0.59) LTA4HKMT2AMEN1ALDH1A1SLC6A4
SCHEMBL172590 0.73
SCHEMBL217345 0.73 MEN1 (0.62) LTA4HKMT2AMEN1TDP1ALDH1A1
SCHEMBL18656958 0.73
SCHEMBL19219865 0.73
Ammonia Solution, Strong SCHEMBL8976504 0.72 MEN1 (0.57) LTA4HKMT2AMEN1ALDH1A1SLC6A4
SCHEMBL631023 0.72 ALDH1A1 (0.66) LTA4HKMT2AMEN1TDP1ALDH1A1

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-2192087-A1 ALKALI METAL FLUORIDE DISPERSION, AND PROCESS FOR PRODUCTION OF FLUORINATED ORGANIC COMPOUND USING THE SAME Sumitomo Chemical Company, Limited (JP) 2010-06-02 EP disclosed