SCHEMBL10020116

SCHEMBL10020116

CCCCCc1ccc(COc2ccc3c(c2F)C(F)C(F)c2c-3ccc(CCC)c2F)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.35
RARB P10826 1/20 0.34
HTT P42858 4/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 2/20 0.33
APAF1 O14727 1/20 0.33
THRB P10828 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RAD52 P43351 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL10020009 0.93 HTT (0.34) S1PR1RARBHTTMAPTMAPK1
SCHEMBL10020140 0.92 RXRG (0.36) S1PR1HTTMAPTMAPK1APAF1
SCHEMBL10019943 0.89 SMPD1 (0.38) RARBHTTMAPTMAPK1APAF1
SCHEMBL10020154 0.87 GABRA1 (0.38) S1PR1HTTMAPTMAPK1THRB
SCHEMBL10020103 0.87 CTSL (0.33) S1PR1CTSLCTSSCTSKS1PR5
SCHEMBL10020135 0.87 CTSL (0.38) HTTMAPTKMT2AMEN1CTSL
SCHEMBL19621962 0.87 CTSL (0.38) HTTMAPTKMT2AMEN1CTSL
SCHEMBL10020039 0.87 S1PR1 (0.40) S1PR1RARBHTTMAPTKMT2A
SCHEMBL10019976 0.86 RARB (0.39) S1PR1RARB
SCHEMBL10019632 0.85 CTSL (0.38) HTTMAPTKMT2AMEN1CTSL

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