SCHEMBL10020160

SCHEMBL10020160

CCCCCc1ccc(CCc2ccc3c(c2F)C(F)C(F)c2c-3ccc(CCC)c2F)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX5 P09917 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CTSL P07711 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
ELANE P08246 2/20 0.32
CTSG P08311 2/20 0.32
LIPG Q9Y5X9 1/20 0.32
GPR3 P46089 1/20 0.30
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 1/20 0.30

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
SCHEMBL10019870 0.97 TYR (0.39) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL10019561 0.94 CTSL (0.40) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL10019843 0.90 ESR1 (0.38) TP53CYP3A4LIPG
SCHEMBL10020036 0.87 S1PR1 (0.37) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL10020135 0.86 CTSL (0.38) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL19621962 0.86 CTSL (0.38) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL10019632 0.86 CTSL (0.38) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL10020039 0.85 S1PR1 (0.40) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL10019996 0.84 TYR (0.34) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL10019972 0.84 RARB (0.43) MEN1TP53CYP3A4MAPTTSHR

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