SCHEMBL10019936

SCHEMBL10019936

CCOc1ccc2c(c1F)C(F)(F)C(F)(F)c1c-2ccc(OCC2CCC(OCC)CC2)c1F

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.33
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
HTR2B P41595 2/20 0.32
ACACB O00763 5/20 0.32
RIPK1 Q13546 1/20 0.32
VEGFA P15692 1/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
SSTR5 P35346 1/20 0.31
KCNH2 Q12809 1/20 0.31
BRD4 O60885 2/20 0.31

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
SCHEMBL10019611 0.88 RIPK1 (0.34) HTR2AHTR2CHTR2BRIPK1VEGFA
SCHEMBL15257919 0.86 FPR2 (0.32) ACACBALOX5APFEN1
SCHEMBL10019848 0.85
SCHEMBL10019616 0.85 RIPK1 (0.32) HTR2AHTR2CHTR2BRIPK1PTGDR2
SCHEMBL10019793 0.84 NAAA (0.37) ACACB
SCHEMBL10019950 0.83 NR3C1 (0.31) RIPK1
SCHEMBL10019940 0.81 HTR2A (0.35) LRRK2HTR2AHTR2CHTR2BACACB
SCHEMBL10019598 0.81 FGFR2 (0.30)
SCHEMBL15257985 0.81
SCHEMBL14767045 0.81 HTR2A (0.36) LRRK2HTR2AHTR2CHTR2BALOX5AP

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