SCHEMBL19829154

SCHEMBL19829154

Cc1ccc(-c2ccc(C(F)(F)Oc3cc(F)c(OCF)c(F)c3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.33
PPARD Q03181 1/20 0.32
HTR2A P28223 1/20 0.30
SLC6A4 P31645 1/20 0.30
KCNH2 Q12809 1/20 0.30
PTPN5 P54829 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
SCHEMBL19829108 0.87 FFAR4 (0.35) FFAR4PPARD
SCHEMBL19829135 0.87 FFAR4 (0.32) FFAR4
SCHEMBL19829155 0.85 MAOB (0.35) FFAR4
SCHEMBL19829125 0.84 MAOB (0.39) FFAR4
SCHEMBL20380591 0.83
SCHEMBL4432399 0.83 PTPN5 (0.34) PPARDHTR2ASLC6A4KCNH2PTPN5
SCHEMBL17548018 0.83 PTPN5 (0.34) PPARDHTR2ASLC6A4KCNH2PTPN5
SCHEMBL18310544 0.82 ALOX5AP (0.33) FFAR4
SCHEMBL18735536 0.81 FFAR4 (0.32) FFAR4PPARD
SCHEMBL18887780 0.80 AKR1C3 (0.32) FFAR4

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
US-20180030351-A1 LIQUID CRYSTAL COMPOUND HAVING POLYFLUORO-2-BUTENOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-02-01 US disclosed