SCHEMBL10020102

SCHEMBL10020102

C=CCCc1ccc(COc2ccc3c(c2F)C(F)C(F)c2c-3ccc(OCC)c2F)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.36
NAAA Q02083 1/20 0.33
GABRA1 P14867 3/20 0.33
GABRB2 P47870 3/20 0.33
CALM1 P0DP23 3/20 0.32
LMNA P02545 3/20 0.31
PTGDR2 Q9Y5Y4 2/20 0.31
MAPT P10636 3/20 0.30
MEN1 O00255 3/20 0.30
ALDH1A1 P00352 3/20 0.30
KMT2A Q03164 3/20 0.30
KDM4E B2RXH2 2/20 0.30
XBP1 P17861 2/20 0.30
HPGD P15428 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
THRB P10828 1/20 0.30
BLM P54132 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
SCHEMBL10020005 0.94 PKM (0.33) PKMNAAAGABRA1GABRB2CALM1
SCHEMBL10020103 0.92 CTSL (0.33)
SCHEMBL10020161 0.92 RXRG (0.36) PKMNAAAGABRA1GABRB2LMNA
SCHEMBL10019967 0.91 CALM1 (0.33) GABRA1GABRB2CALM1LMNAMEN1
SCHEMBL10020154 0.88 GABRA1 (0.38) PKMNAAAGABRA1GABRB2CALM1
SCHEMBL10019939 0.87 GAA (0.35) PKMGABRA1GABRB2LMNAMAPT
SCHEMBL10020191 0.86 PKM (0.33) PKM
SCHEMBL10020007 0.86 FFAR4 (0.32) GABRA1GABRB2
SCHEMBL10019835 0.85 GABRA1 (0.33) GABRA1GABRB2CALM1LMNA
SCHEMBL10019664 0.85 PKM (0.32) PKM

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