SCHEMBL17286706

SCHEMBL17286706

CCc1cc(C(C)(O)C(F)(F)F)cc(C)c1OC

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.40
DHFR P00374 1/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP2C19 P33261 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
PGR P06401 1/20 0.32
NR3C1 P04150 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL17286718 0.85 HSD11B1 (0.42) HSD11B1ALDH1A1CYP2C9
SCHEMBL13452244 0.80 DHFR (0.41) DHFRALDH1A1CYP2C19CYP2C9NR3C1
SCHEMBL17286705 0.79 HSD11B1 (0.42) HSD11B1CYP2C19CYP2C9PGR
SCHEMBL17072152 0.77 DHFR (0.40) DHFRALDH1A1CYP2C19LMNASMN1; SMN2
SCHEMBL20987916 0.73 CYP3A4 (0.37) DHFRALDH1A1CYP2C19CYP3A4CYP2C9
SCHEMBL25596263 0.73 HSD11B1 (0.34) HSD11B1LMNA
SCHEMBL14999487 0.70 PTGS2 (0.39) DHFRALDH1A1CYP2C19CYP2C9LMNA
SCHEMBL13310100 0.70 DHFR (0.44) DHFRALDH1A1CYP2C19PGRNR3C1
SCHEMBL13707222 0.70 CYP2C19 (0.41) DHFRALDH1A1CYP2C19CYP2C9LMNA
SCHEMBL17286719 0.69 ACHE (0.35) HSD11B1ALDH1A1PGRNR3C1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464163-B2 Novolak resin containing hexafluoroisopropanol group, method for producing same, and composition of same CENTRAL GLASS COMPANY, LIMITED (JP) 2016-10-11 US disclosed
US-20150337077-A1 Novolak Resin Containing Hexafluoroisopropanol Group, Method for Producing Same, and Composition of Same CENTRAL GLASS COMPANY, LIMITED (JP) 2015-11-26 US disclosed