SCHEMBL10020133

SCHEMBL10020133

CCOc1ccc(COc2ccc3c(c2F)C(F)C(F)c2c-3ccc(OCC)c2F)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.34
NAAA Q02083 1/20 0.33
KDM1A O60341 4/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
XBP1 P17861 1/20 0.31
BLM P54132 1/20 0.31
CTSL P07711 1/20 0.31
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MRGPRX4 Q96LA9 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
SCHEMBL10019665 0.97 PKM (0.34) PKMNAAAKDM1AMEN1KMT2A
SCHEMBL10020159 0.93 CTSL (0.40) PKMNAAACTSLCTSSCTSK
SCHEMBL10019631 0.92 CTSL (0.39) PKMCTSLCTSSCTSK
SCHEMBL10020030 0.89 CACNA1C (0.39) NAAAL3MBTL1ALDH1A1GAAMAPT
SCHEMBL10020185 0.88 CTSL (0.36) NAAAKDM1AL3MBTL1CTSLCTSS
SCHEMBL10020191 0.88 PKM (0.33) PKMCTSLCTSSCTSK
SCHEMBL10019664 0.87 PKM (0.32) PKMCTSLCTSSCTSK
SCHEMBL19621885 0.87 L3MBTL1 (0.37) PKMKDM1AL3MBTL1KDM4EALDH1A1
SCHEMBL10020016 0.86 CACNA1C (0.38) PKMNAAAKDM1AMEN1KMT2A
SCHEMBL10020156 0.86 CACNA1C (0.39) PKMNAAAKDM1AMEN1KMT2A

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