SCHEMBL6667080

SCHEMBL6667080

CCc1ccc(C(F)(F)OCCc2ccc(C(F)(F)F)c(F)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.40
KIF11 P52732 8/20 0.38
TRPM8 Q7Z2W7 1/20 0.36
FFAR4 Q5NUL3 2/20 0.35
FFAR1 O14842 1/20 0.35
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
P2RX7 Q99572 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
S1PR1 P21453 1/20 0.31
IDO1 P14902 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
SCHEMBL6667145 0.91 DAO (0.40) DAOKIF11TRPM8FFAR1PPARG
SCHEMBL6664131 0.87 KIF11 (0.33) DAOKIF11FFAR4TAAR1IDO1
SCHEMBL6666296 0.87 S1PR1 (0.38) DAOKIF11S1PR1
SCHEMBL6662044 0.85 DAO (0.35) DAOKIF11FFAR4TAAR1IDO1
SCHEMBL6662997 0.85 KIF11 (0.33) KIF11FFAR4TAAR1IDO1
SCHEMBL6666318 0.82 CACNA1H (0.36) P2RX7
SCHEMBL7731827 0.82 DAO (0.41) DAOKIF11TRPM8FFAR4FFAR1
SCHEMBL6662025 0.81 TAAR1 (0.46) DAOPPARDPPARATAAR1IDO1
SCHEMBL6665018 0.81 DAO (0.39) DAOCYP11B1CYP11B2
SCHEMBL6664049 0.80 FFAR4 (0.35) KIF11FFAR4FFAR1PPARDPPARA

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