SCHEMBL10020136

SCHEMBL10020136

CCOc1ccc(COc2ccc3c(c2F)C(F)(F)C(F)(F)c2c-3ccc(OCC)c2F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.39
FFAR1 O14842 8/20 0.39
PPARD Q03181 5/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
KDM1A O60341 2/20 0.37
S1PR5 Q9H228 3/20 0.36
S1PR1 P21453 2/20 0.35
NR3C2 P08235 1/20 0.35
TACR2 P21452 1/20 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
SCHEMBL10020137 0.88 RXRG (0.39) MRGPRX4FFAR1PPARDPPARGPPARA
SCHEMBL10020003 0.86 GABRA1 (0.36) FFAR1PPARDPPARGPPARAKDM1A
SCHEMBL10019944 0.85 MAOB (0.38) MRGPRX4FFAR1PPARDPPARGPPARA
SCHEMBL10020028 0.85 CALM1 (0.36) KDM1A
SCHEMBL10019942 0.84 GABRA1 (0.34) MRGPRX4FFAR1TACR2
SCHEMBL10020187 0.83 RXRG (0.36) MRGPRX4FFAR1PPARDPPARGPPARA
SCHEMBL10020098 0.83 GABRA1 (0.38) PPARAS1PR5S1PR1
SCHEMBL10020015 0.82 PKM (0.33) FFAR1PPARDPPARGPPARA
SCHEMBL10020017 0.82 FFAR1 (0.39) FFAR1PPARDPPARGPPARAHTT
SCHEMBL17490328 0.82 FFAR1 (0.44) MRGPRX4FFAR1PPARDPPARGPPARA

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
EP-2669263-B1 COMPOUND CONTAINING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2017-11-22 EP disclosed
US-9193908-B2 Compound having dihydrophenanthrene, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-9193908-B2 Compound having dihydrophenanthrene, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-20130240784-A1 COMPOUND HAVING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2013-09-19 US disclosed
US-20130240784-A1 COMPOUND HAVING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2013-09-19 US disclosed
WO-2012086437-A1 COMPOUND CONTAINING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY JNC株式会社 (JP) 2012-06-28 WO disclosed