SCHEMBL17548015

SCHEMBL17548015

Cc1ccc(-c2ccc(C(F)(F)Oc3ccc(C)c(F)c3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.34
GPR3 P46089 1/20 0.34
MAPT P10636 3/20 0.33
TP53 P04637 1/20 0.33
HTR2A P28223 1/20 0.33
SLC6A4 P31645 1/20 0.33
KCNH2 Q12809 1/20 0.33
PTPN5 P54829 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
AR P10275 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
CYP11B1 P15538 2/20 0.31
CYP11B2 P19099 2/20 0.31
NPBWR1 P48145 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TRPV1 Q8NER1 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
SCHEMBL12829125 0.95 GPR3 (0.36) GPR3MAPTHTR2ASLC6A4KCNH2
SCHEMBL4431222 0.89 NFE2L2 (0.38) PPARDGPR3MAPTHTR2ASLC6A4
SCHEMBL4432399 0.88 PTPN5 (0.34) PPARDMAPTHTR2ASLC6A4KCNH2
SCHEMBL17548018 0.88 PTPN5 (0.34) PPARDMAPTHTR2ASLC6A4KCNH2
SCHEMBL19019611 0.85 GPR3 (0.33) PPARDGPR3MAPTHTR2ASLC6A4
SCHEMBL12152581 0.84 ACHE (0.38) PPARDHTR2ASLC6A4KCNH2PTPN5
SCHEMBL10018707 0.84 ACHE (0.38) PPARDHTR2ASLC6A4KCNH2PTPN5
SCHEMBL2741545 0.82 TSHR (0.34) GPR3HTR2ASLC6A4KCNH2AR
SCHEMBL12829123 0.82 TSHR (0.34) GPR3HTR2ASLC6A4KCNH2AR
SCHEMBL91729 0.82 ERN1 (0.32) MAPTTP53NISCHFFAR4TRPV1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9487704-B2 Nematic liquid crystal composition and liquid crystal display element using same DIC CORPORATION (JP) 2016-11-08 US disclosed
US-20160319195-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2016-11-03 US disclosed
US-20160060526-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2016-03-03 US disclosed