SCHEMBL10019944

SCHEMBL10019944

CCOc1ccc(COc2ccc3c(c2F)C(F)(F)C(F)(F)c2c-3ccc(OCC)c2F)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.38
NQO1 P15559 1/20 0.38
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KDM4E B2RXH2 1/20 0.37
PLA2G1B P04054 1/20 0.37
GAA P10253 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
FFAR1 O14842 2/20 0.35
PPARD Q03181 2/20 0.35
TACR2 P21452 1/20 0.35
BCHE P06276 1/20 0.35

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
SCHEMBL10019942 0.88 GABRA1 (0.34) ALDH1A1MAPTKDM4EGAACYP2D6
SCHEMBL10020136 0.85 MRGPRX4 (0.39) LMNAFFAR1PPARDTACR2PPARG
SCHEMBL10020013 0.85 CACNA1C (0.39) MAOBNQO1ALDH1A1LMNAMAPT
SCHEMBL10019839 0.85 NQO1 (0.34) NQO1ALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL10019935 0.83 GAA (0.35) ALDH1A1LMNAMAPTNPC1RAB9A
SCHEMBL10020181 0.82 CACNA1C (0.39) MAOBALDH1A1LMNAMAPTKDM4E
SCHEMBL10020137 0.82 RXRG (0.39) ALDH1A1LMNAMAPTKDM4EPLA2G1B
SCHEMBL10020006 0.82 FFAR4 (0.35) MAOBFFAR1
SCHEMBL10019621 0.82 PKM (0.34) L3MBTL1MRGPRX4PKM
SCHEMBL10020119 0.82 PKM (0.34) L3MBTL1MRGPRX4PKM

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