SCHEMBL19985380

SCHEMBL19985380

C/C=C\CC1CCC(c2ccc(-c3ccc(OCCCC)c(F)c3F)cc2)CC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.34
RAB9A P51151 1/20 0.32
CYP2C9 P11712 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 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
SCHEMBL19985381 0.97 FFAR4 (0.32) FFAR4
SCHEMBL19985389 0.96 SPHK1 (0.33) FFAR4
SCHEMBL19985383 0.96 SPHK1 (0.33) FFAR4
SCHEMBL19985386 0.96 SPHK1 (0.33) FFAR4
SCHEMBL19985382 0.96 SPHK1 (0.33) FFAR4
SCHEMBL19985377 0.95 FPR2 (0.33) FFAR4
SCHEMBL19985385 0.92 RAB9A (0.32) FFAR4RAB9ACYP2C9HRH3PDE4A
SCHEMBL19985372 0.91 KDM1A (0.33) FFAR4CYP2C9
SCHEMBL19985404 0.90 ALOX5 (0.34) FFAR4RAB9ACYP2C9HRH3PDE4A
SCHEMBL19985399 0.89 SPHK1 (0.31)

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