SCHEMBL19985370

SCHEMBL19985370

C/C=C/C1CCC(c2ccc(-c3ccc(OCCCC)c(F)c3F)cc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
HRH3 Q9Y5N1 2/20 0.32
CYP2C9 P11712 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
CNR2 P34972 2/20 0.31
CNR1 P21554 1/20 0.31
CRBN Q96SW2 1/20 0.31
SPHK1 Q9NYA1 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
FPR2 P25090 1/20 0.30
MCHR1 Q99705 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
SCHEMBL19985378 0.97 SPHK1 (0.32) RAB9AFFAR4CNR2CNR1SPHK1
SCHEMBL19985379 0.96 SPHK1 (0.34) SPHK1FPR2
SCHEMBL19985373 0.96 SPHK1 (0.34) SPHK1FPR2
SCHEMBL19985374 0.96 SPHK1 (0.34) SPHK1FPR2
SCHEMBL19985375 0.96 SPHK1 (0.34) SPHK1FPR2
SCHEMBL19985369 0.94 FPR2 (0.34) PDE4AFPR2
SCHEMBL8933682 0.93 PDE4A (0.33) FFAR4CYP2C9PDE4APDE4BPDE4C
SCHEMBL19985371 0.91 KDM1A (0.34) FFAR4FPR2
SCHEMBL15681333 0.91 KDM1A (0.34) FFAR4FPR2
SCHEMBL8935246 0.90 SCN9A (0.32) CNR2CNR1CHRM2CHRM4CHRM5

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-20210095208-A1 LIQUID CRYSTAL COMPOSITION AND PHOTOELECTRIC DISPLAY DEVICE THEREOF JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2021-04-01 US disclosed
US-20210095209-A1 LIQUID CRYSTAL COMPOSITION AND PHOTOELECTRIC DISPLAY DEVICE THEREOF JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2021-04-01 US disclosed
US-20180079959-A1 LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY DIC CORPORATION (JP) 2018-03-22 US disclosed