SCHEMBL8595294

SCHEMBL8595294

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

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
KDM4E B2RXH2 1/20 0.30
ASPH Q12797 1/20 0.30
KDM8 Q8N371 1/20 0.30
CES2 O00748 1/20 0.30
CES1 P23141 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
SCHEMBL9566673 0.86 KEAP1 (0.36) MAPTKEAP1NFE2L2
SCHEMBL7813771 0.83 KEAP1 (0.37) MAPTKEAP1NFE2L2KDM4EASPH
SCHEMBL9566655 0.79 KEAP1 (0.34) MAPTKEAP1NFE2L2KDM4EASPH
SCHEMBL9566702 0.78 MAPT (0.35) MAPTKEAP1NFE2L2KDM4EASPH
SCHEMBL9566689 0.77 KEAP1 (0.33) MAPTKEAP1NFE2L2
SCHEMBL9566700 0.77 KEAP1 (0.33) MAPTKEAP1NFE2L2
SCHEMBL8946844 0.76 MAPT (0.41) MAPTKEAP1NFE2L2KDM4EASPH
SCHEMBL9566709 0.76 LMNA (0.35) MAPTKEAP1NFE2L2
SCHEMBL9566656 0.75 KEAP1 (0.34) MAPTKEAP1NFE2L2
SCHEMBL9566669 0.74 MAPT (0.40) MAPTKEAP1NFE2L2KDM4EASPH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0667334-B1 Process for the preparation of 4-alkoxy-3,5,6-trifluorophthalic acids and 3-alkoxy-2,4,5-trifluorobenzoic acids CLARIANT GMBH (DE) 1998-01-07 EP disclosed
US-5488152-A Process for the preparation of 4-alkoxy-3,5,6-trifluoro-phthalic acids and 3-alkoxy-2,4,5-trifluorobenzoic acids HOECHST AKTIENGESELLSCHAFT (DE) 1996-01-30 US disclosed
EP-0667334-A2 Process for the preparation of 4-alkoxy-3,5,6-trifluorophthalic acids and 3-alkoxy-2,4,5-trifluorobenzoic acids HOECHST AKTIENGESELLSCHAFT (DE) 1995-08-16 EP disclosed