SCHEMBL28100337

SCHEMBL28100337

F[C](F)F.Oc1cc[c]cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA3 P07451 4/20 0.41
CA14 Q9ULX7 4/20 0.41
CA12 O43570 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 3/20 0.41
ALOX15 P16050 3/20 0.41
CA1 P00915 2/20 0.41
CA4 P22748 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 2/20 0.41
HIF1A Q16665 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
GMNN O75496 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
TYR P14679 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
SCHEMBL3290 0.90
SCHEMBL28359591 0.87
SCHEMBL20525519 0.87
SCHEMBL28367163 0.87
SCHEMBL5852519 0.87
Hydrochloric Acid SCHEMBL5384250 0.87
SCHEMBL5852514 0.87
SCHEMBL28664799 0.87
Ammonia Solution, Strong SCHEMBL27547289 0.87
SCHEMBL27566528 0.87

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
CN-105980362-A Ethereal oxygen-containing perfluoroalkyl group-substituted pyrazole compound and production method therefor 旭硝子株式会社 2016-09-28 CN disclosed