SCHEMBL6663768

SCHEMBL6663768

CCCCCC1CCC(c2ccc(C(F)(F)OC(C)c3ccc(OC(F)(F)F)cc3)c(F)c2)CC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.32
KDM1A O60341 1/20 0.31
RCOR1 Q9UKL0 1/20 0.31
PPARG P37231 2/20 0.31
PPARD Q03181 2/20 0.31
PPARA Q07869 2/20 0.31
PTGS2 P35354 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
SCHEMBL6663902 0.93 CYP2C9 (0.34) PDE2AKDM1ARCOR1PPARGPPARD
SCHEMBL6665410 0.92 CYP2C9 (0.33)
SCHEMBL6666216 0.91 CYP2C9 (0.37)
SCHEMBL6667632 0.91 CYP2C9 (0.37)
SCHEMBL6664190 0.90 CYP2C9 (0.32)
SCHEMBL6664046 0.90 CYP2C9 (0.32)
SCHEMBL6663286 0.89 PDE2A (0.36) PDE2A
SCHEMBL6663151 0.89
SCHEMBL6664208 0.89 PDE2A (0.33) PDE2AKDM1ARCOR1PPARGPPARD
SCHEMBL6666680 0.89 CYP2C9 (0.31)

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-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed