SCHEMBL10020060

SCHEMBL10020060

CCCC1CCC(COc2ccc3c(c2F)C(F)(F)C(F)(F)c2c-3ccc(C3CCC(CCC)CC3)c2F)CC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.36
FEN1 P39748 3/20 0.36
CNR2 P34972 10/20 0.35
SCN9A Q15858 4/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
SCN5A Q14524 1/20 0.33
CNR1 P21554 1/20 0.33
RIPK1 Q13546 1/20 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
SCHEMBL10019885 0.92 CYP2C9 (0.32) ALOX5APFEN1
SCHEMBL10019611 0.91 RIPK1 (0.34) ALOX5APFEN1HTR2AHTR2CHTR2B
SCHEMBL19621908 0.87 KCNN4 (0.35) HTR2AHTR2CHTR2BRIPK1
SCHEMBL10019958 0.84 GAA (0.32)
SCHEMBL12740619 0.84 CNR2 (0.37) ALOX5APFEN1CNR2SCN9AHTR2A
SCHEMBL12735769 0.84 CNR2 (0.37) ALOX5APFEN1CNR2SCN9AHTR2A
SCHEMBL21787346 0.83 CNR2 (0.36) ALOX5APFEN1CNR2SCN9AHTR2A
SCHEMBL13293549 0.83 ALOX5AP (0.39) ALOX5APFEN1CNR2SCN9AHTR2A
SCHEMBL10019616 0.83 RIPK1 (0.32) HTR2AHTR2CHTR2BRIPK1
SCHEMBL10019811 0.82 PDK2 (0.41)

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