SCHEMBL15340288

SCHEMBL15340288

CCOc1ccc(C2CCC(c3ccc(C4CCC(C)CC4)c(C)c3F)CO2)cc1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPK1 P28482 1/20 0.30
BACE1 P56817 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
SCHEMBL15343834 0.87 TP53 (0.30)
SCHEMBL15340326 0.82 MAPT (0.36) MAPT
SCHEMBL15340283 0.82 MAPT (0.36) KDM4EMAPTALDH1A1
SCHEMBL15340286 0.78 OPRL1 (0.32) MAPT
SCHEMBL15340006 0.78 MAPT (0.31) MAPT
SCHEMBL15340299 0.77 MEN1 (0.34) KDM4EMAPTALDH1A1
SCHEMBL15340284 0.77 FASN (0.33) MAPTALDH1A1MAPK1
SCHEMBL15340278 0.75
SCHEMBL15340301 0.75 CYP2C9 (0.37) MAPTALDH1A1MAPK1
SCHEMBL15343559 0.75 RAB9A (0.32) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9102871-B2 Liquid crystal compound showing negative dielectric anisotropy, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-08-11 US disclosed
US-20130277610-A1 LIQUID CRYSTAL COMPOUND SHOWING NEGATIVE DIELECTRIC ANISOTROPY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2013-10-24 US disclosed