SCHEMBL10019980

SCHEMBL10019980

CCCc1ccc(-c2ccc3c(c2F)C(F)C(F)c2c-3ccc(OCC)c2F)c(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.46
CTSK P43235 2/20 0.46
CTSL P07711 1/20 0.46
GABRA1 P14867 2/20 0.32
GABRB2 P47870 2/20 0.32
NAAA Q02083 1/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31

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
SCHEMBL10020114 0.93 CTSL (0.41) CTSSCTSKCTSLGABRA1GABRB2
SCHEMBL10019899 0.93 CTSL (0.40) CTSSCTSKCTSLGABRA1GABRB2
SCHEMBL10020159 0.91 CTSL (0.40) CTSSCTSKCTSLGABRA1GABRB2
SCHEMBL10019631 0.90 CTSL (0.39) CTSSCTSKCTSLGABRA1GABRB2
SCHEMBL10020185 0.89 CTSL (0.36) CTSSCTSKCTSLNAAA
SCHEMBL12579513 0.87 CTSS (0.56) CTSSCTSKCTSLGABRA1GABRB2
SCHEMBL10019994 0.87 CTSS (0.37) CTSSCTSKCTSL
SCHEMBL19621911 0.85 L3MBTL1 (0.36) CTSSCTSKCTSL
SCHEMBL10019849 0.85 GABRA1 (0.36) CTSSCTSKCTSLGABRA1GABRB2
SCHEMBL15257996 0.85 CTSS (0.36) CTSSCTSKCTSLGABRA1GABRB2

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