SCHEMBL15744390

SCHEMBL15744390

CCCc1ccc(-c2ccc(-c3ccc(C(F)(F)OC(F)(F)F)cc3)c(F)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.41
RARA P10276 1/20 0.38
RARG P13631 1/20 0.38
KIF11 P52732 1/20 0.38
MAOB P27338 2/20 0.37
AKR1C3 P42330 2/20 0.37
AKR1C2 P52895 2/20 0.37
APP P05067 1/20 0.36
RORC P51449 5/20 0.36
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
MCL1 Q07820 1/20 0.35
RORA P35398 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
GRM2 Q14416 2/20 0.34

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
SCHEMBL15744475 0.87 RARB (0.38) RARBRARARARGKIF11MAOB
SCHEMBL15744315 0.87 RARB (0.38) RARBRARARARGKIF11MAOB
SCHEMBL15744387 0.85 RARB (0.43) RARBRARARARGKIF11MAOB
SCHEMBL10603849 0.84 RARB (0.51) RARBRARARARGKIF11MAOB
SCHEMBL9512294 0.84 RARB (0.51) RARBRARARARGKIF11MAOB
SCHEMBL13198653 0.84 RARB (0.37) RARBRARARARGKIF11MAOB
SCHEMBL15783711 0.83 GRM2 (0.39) RARBRARARARGKIF11MAOB
SCHEMBL15744512 0.83 GRM2 (0.38) RARBRARARARGMAOBS1PR1
SCHEMBL20202978 0.83 RARB (0.50) RARBRARARARGKIF11MAOB
SCHEMBL9227374 0.83 GRM2 (0.47) RARBRARARARGKIF11S1PR1

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-9365774-B2 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-06-14 US disclosed
US-9365774-B2 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-06-14 US disclosed
EP-2735599-B1 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC CORP (JP) 2015-04-29 EP disclosed
US-20140145113-A1 LIQUID CRYSTAL COMPOUND HAVING CF2OCF3 AT TERMINAL, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-29 US disclosed
US-20140145113-A1 LIQUID CRYSTAL COMPOUND HAVING CF2OCF3 AT TERMINAL, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-29 US disclosed
EP-2735599-A1 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC Corporation (JP) 2014-05-28 EP disclosed