SCHEMBL10065877

SCHEMBL10065877

C=CC1CCC(c2ccc(-c3ccc(-c4ccc(CCC)cc4)c(F)c3)cc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.37
CYP2C9 P11712 2/20 0.37
APP P05067 2/20 0.37
RARB P10826 3/20 0.37
SPHK1 Q9NYA1 11/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
RARA P10276 1/20 0.34
RARG P13631 1/20 0.34
SPHK2 Q9NRA0 5/20 0.33

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
SCHEMBL19702999 0.93 SPHK1 (0.43) CYP3A4CYP2C9RARBSPHK1FFAR4
SCHEMBL19702994 0.92 SPHK1 (0.47) RARBSPHK1FFAR4RARARARG
SCHEMBL19702996 0.91 CYP3A4 (0.38) CYP3A4CYP2C9APPRARBSPHK1
SCHEMBL19702997 0.88 CYP3A4 (0.36) CYP3A4CYP2C9APPRARBSPHK1
SCHEMBL8725259 0.86 CYP3A4 (0.34) CYP3A4CYP2C9APPRARBCYP2D6
SCHEMBL13245999 0.86 FASN (0.42) CYP3A4CYP2C9APPRARBSPHK1
SCHEMBL16286047 0.86 FASN (0.42) CYP3A4CYP2C9APPRARBSPHK1
SCHEMBL8728184 0.85 CYP3A4 (0.36) CYP3A4CYP2C9APPCYP2D6CYP2C19
SCHEMBL8725252 0.85 CYP3A4 (0.36) CYP3A4CYP2C9APPCYP2D6CYP2C19
SCHEMBL8731484 0.85 RARB (0.37) CYP3A4CYP2C9APPRARBSPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10344211-B2 Liquid crystal composition and liquid crystal display element using same DIC CORPORATION (JP) 2019-07-09 US disclosed
US-20170355906-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2017-12-14 US disclosed
US-20170355906-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2017-12-14 US disclosed
EP-2468707-A1 DECAHYDRONAPHTHALENE COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS CONTAINING THE COMPOUNDS, AND LIQUID CRYSTAL DISPLAY ELEMENTS CONTAINING THE LIQUID CRYSTAL COMPOSITIONS JNC Corporation (JP) 2012-06-27 EP disclosed
EP-2308950-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT Chisso Corporation (JP) 2011-04-13 EP disclosed
EP-2006352-A1 LIQUID-CRYSTAL COMPOSITION AND LIQUID-CRYSTAL ELEMENT Chisso Corporation (JP) 2008-12-24 EP disclosed