SCHEMBL8944143

SCHEMBL8944143

CCCCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)c(F)c4F)cc3)c(F)c2)CO1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.34
ALOX5 P09917 1/20 0.34
RARB P10826 1/20 0.33
ALDH1A1 P00352 1/20 0.33
FASN P49327 1/20 0.32
PPARG P37231 1/20 0.31
CYP1A2 P05177 2/20 0.30
GRM2 Q14416 1/20 0.30
S1PR1 P21453 4/20 0.30
SGPL1 O95470 3/20 0.30
DGAT1 O75907 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
APP P05067 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
SCHEMBL8943319 0.99 ALOX5 (0.34) EPHX1ALOX5RARBALDH1A1FASN
SCHEMBL8943262 0.92 ALOX5 (0.36) ALOX5FASNDGAT1CYP3A4CYP2C9
SCHEMBL8943604 0.90 RARB (0.34) EPHX1ALOX5RARBALDH1A1FASN
SCHEMBL8944268 0.89 RARB (0.36) EPHX1ALOX5RARBALDH1A1FASN
SCHEMBL8943727 0.89 RARB (0.36) EPHX1ALOX5RARBALDH1A1FASN
SCHEMBL8943907 0.89 ALOX5 (0.34) EPHX1ALOX5RARBALDH1A1FASN
SCHEMBL8943434 0.89 RARB (0.36) EPHX1ALOX5RARBALDH1A1FASN
SCHEMBL8943432 0.89 RARB (0.36) EPHX1ALOX5RARBALDH1A1FASN
SCHEMBL8944253 0.89 RARB (0.36) EPHX1ALOX5RARBALDH1A1FASN
SCHEMBL8943741 0.89 RARB (0.36) EPHX1ALOX5RARBALDH1A1FASN

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-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed
EP-2206695-A1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT Chisso Corporation (JP) 2010-07-14 EP disclosed