SCHEMBL19985177

SCHEMBL19985177

CCCCCCCOc1ccc(C2CCC(C3CCC(CCCC)CC3)CC2)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
SCN9A Q15858 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PPARG P37231 1/20 0.32
PLA2G2D Q9UNK4 1/20 0.32
FPR2 P25090 1/20 0.32

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
SCHEMBL9630292 1.00 CNR1 (0.34) CNR1CNR2GAAMAPTSCN9A
SCHEMBL19985185 1.00 CNR1 (0.34) CNR1CNR2GAAMAPTSCN9A
SCHEMBL19985206 1.00 CNR1 (0.34) CNR1CNR2GAAMAPTSCN9A
SCHEMBL9630299 1.00 CNR1 (0.34) CNR1CNR2GAAMAPTSCN9A
SCHEMBL9631326 0.99 GAA (0.33) CNR1CNR2GAAMAPTSCN9A
SCHEMBL9631315 0.99 GAA (0.33) CNR1CNR2GAAMAPTSCN9A
SCHEMBL19985192 0.98 GAA (0.35) CNR1CNR2GAAMAPTSCN9A
SCHEMBL19985207 0.98 GAA (0.35) CNR1CNR2GAAMAPTSCN9A
SCHEMBL19985200 0.98 GAA (0.35) CNR1CNR2GAAMAPTSCN9A
SCHEMBL19985224 0.98 GAA (0.35) CNR1CNR2GAAMAPTSCN9A

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