SCHEMBL9566673

SCHEMBL9566673

O=C(O)c1cc(F)c(F)c(OC(F)(F)CCl)c1F

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
MAPT P10636 1/20 0.34
MRGPRX4 Q96LA9 2/20 0.32
AKR1C2 P52895 1/20 0.30
AKR1C1 Q04828 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
SCHEMBL8595294 0.86 MAPT (0.35) KEAP1NFE2L2MAPT
SCHEMBL7813771 0.82 KEAP1 (0.37) KEAP1NFE2L2MAPTAKR1C2AKR1C1
SCHEMBL9566655 0.78 KEAP1 (0.34) KEAP1NFE2L2MAPT
SCHEMBL9566709 0.78 LMNA (0.35) KEAP1NFE2L2MAPTAKR1C2AKR1C1
SCHEMBL9566702 0.77 MAPT (0.35) KEAP1NFE2L2MAPT
SCHEMBL9566656 0.77 KEAP1 (0.34) KEAP1NFE2L2MAPT
Methylene Chloride SCHEMBL28420789 0.76 HSD17B10 (0.40) KEAP1NFE2L2MAPT
SCHEMBL9566700 0.76 KEAP1 (0.33) KEAP1NFE2L2MAPT
SCHEMBL9566689 0.76 KEAP1 (0.33) KEAP1NFE2L2MAPT
SCHEMBL8946844 0.75 MAPT (0.41) KEAP1NFE2L2MAPTMRGPRX4

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-0545866-A1 Process for the preparation of trifluorobenzol derivatives CIBA-GEIGY AG (CH) 1993-06-09 EP disclosed