SCHEMBL15340375

SCHEMBL15340375

CCCC1CCC(c2ccc(-c3ccc(C4CCC(CC)CO4)cc3)c(F)c2C(F)F)CC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.35
CYP2C9 P11712 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
MEN1 O00255 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 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
SCHEMBL13066740 0.92 CYP2C9 (0.33) FASNCYP2C9ALDH1A1LMNAMAPT
SCHEMBL9927747 0.85 FASN (0.39) FASNCYP2C9ALDH1A1LMNAMAPT
SCHEMBL13066729 0.81 CYP2C9 (0.39) FASNCYP2C9ALDH1A1LMNAMAPT
SCHEMBL15340306 0.81 ALOX5 (0.33) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL15340382 0.80 FASN (0.33) FASN
SCHEMBL13209194 0.79 FASN (0.41) FASN
SCHEMBL9927771 0.79 FASN (0.40) FASN
SCHEMBL9927748 0.78 FASN (0.34) FASNMAPT
SCHEMBL9927770 0.78 FASN (0.37) FASN
SCHEMBL15340280 0.77 RAB9A (0.33) CYP2C9

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