SCHEMBL6667145

SCHEMBL6667145

CCCc1ccc(C(F)(F)OCCc2ccc(C(F)(F)F)c(F)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.40
KIF11 P52732 4/20 0.38
TRPM8 Q7Z2W7 1/20 0.35
FFAR1 O14842 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
S1PR1 P21453 1/20 0.33
PPARG P37231 2/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
PTPN7 P35236 1/20 0.32
DUSP3 P51452 1/20 0.32
P2RX7 Q99572 1/20 0.31
MAOB P27338 1/20 0.31
MDM2 Q00987 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
PDK2 Q15119 1/20 0.31
PSMB5 P28074 1/20 0.31
PTGES O14684 1/20 0.31
ALOX5 P09917 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
SCHEMBL6666296 0.91 S1PR1 (0.38) DAOKIF11S1PR1
SCHEMBL6667080 0.91 DAO (0.40) DAOKIF11TRPM8FFAR1TAAR1
SCHEMBL6665130 0.88 TAAR1 (0.33) DAOKIF11TAAR1MAOBPDK2
SCHEMBL6666368 0.88 DAO (0.35) DAOKIF11FFAR1S1PR1PDK2
SCHEMBL6665746 0.85 TAAR1 (0.35) DAOTAAR1PPARGPPARDPPARA
SCHEMBL6662178 0.85 TAAR1 (0.33) KIF11TAAR1PPARGPPARDPPARA
SCHEMBL6661122 0.84 TAAR1 (0.37) KIF11TAAR1
SCHEMBL7722922 0.83 DAO (0.41) DAOKIF11TRPM8FFAR1TAAR1
SCHEMBL6660763 0.83 TAAR1 (0.46) DAOTAAR1PPARGPPARDPPARA
SCHEMBL13002669 0.83 DAO (0.52) DAOKIF11FFAR1P2RX7PDK2

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