SCHEMBL6665746

SCHEMBL6665746

CCCc1ccc(C(F)(F)OCCc2cc(F)c(C(F)(F)F)c(F)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.35
DAO P14920 1/20 0.35
MAOB P27338 2/20 0.32
PTGES O14684 2/20 0.31
ALOX5 P09917 2/20 0.31
PPARG P37231 2/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
IDO1 P14902 4/20 0.31
NPC1 O15118 1/20 0.30
GAA P10253 1/20 0.30
RAB9A P51151 1/20 0.30
THRB P10828 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
SCHEMBL6661191 0.91 HTR2A (0.38) PTGESALOX5PPARGTHRB
SCHEMBL6662044 0.90 DAO (0.35) TAAR1DAOIDO1
SCHEMBL6662178 0.89 TAAR1 (0.33) TAAR1MAOBPTGESALOX5PPARG
SCHEMBL6665130 0.86 TAAR1 (0.33) TAAR1DAOMAOBIDO1NPC1
SCHEMBL6661122 0.85 TAAR1 (0.37) TAAR1IDO1THRB
SCHEMBL6667145 0.85 DAO (0.40) TAAR1DAOMAOBPTGESALOX5
SCHEMBL6663201 0.84 TAAR1 (0.30) TAAR1PPARDPPARA
SCHEMBL6660763 0.84 TAAR1 (0.46) TAAR1DAOMAOBPTGESALOX5
SCHEMBL6666038 0.83 TRPV4 (0.34) GAA
SCHEMBL6661139 0.83 ALDH1A1 (0.41) TAAR1IDO1GAA

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