SCHEMBL19985207

SCHEMBL19985207

CCCCCCCCOc1ccc(C2CCC(C3CCC(CCCCCCC)CC3)CC2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
SCN9A Q15858 1/20 0.33
PPARG P37231 1/20 0.32
PLA2G2D Q9UNK4 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HPGD P15428 1/20 0.32
FPR2 P25090 1/20 0.32
ESR1 P03372 2/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
S1PR5 Q9H228 2/20 0.32
S1PR1 P21453 1/20 0.32
PTPN1 P18031 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
SCHEMBL19985228 1.00 GAA (0.35) GAAMAPTCNR1CNR2SCN9A
SCHEMBL19985189 1.00 GAA (0.35) GAAMAPTCNR1CNR2SCN9A
SCHEMBL19985191 1.00 GAA (0.35) GAAMAPTCNR1CNR2SCN9A
SCHEMBL19985195 1.00 GAA (0.35) GAAMAPTCNR1CNR2SCN9A
SCHEMBL19985209 1.00 GAA (0.35) GAAMAPTCNR1CNR2SCN9A
SCHEMBL19985224 1.00 GAA (0.35) GAAMAPTCNR1CNR2SCN9A
SCHEMBL19985200 1.00 GAA (0.35) GAAMAPTCNR1CNR2SCN9A
SCHEMBL19985188 1.00 GAA (0.35) GAAMAPTCNR1CNR2SCN9A
SCHEMBL19985192 1.00 GAA (0.35) GAAMAPTCNR1CNR2SCN9A
SCHEMBL19985230 1.00 GAA (0.35) GAAMAPTCNR1CNR2SCN9A

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-20180079959-A1 LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY DIC CORPORATION (JP) 2018-03-22 US disclosed