SCHEMBL10019620

SCHEMBL10019620

CCCc1ccc(OCc2ccc3c(c2F)C(F)(F)C(F)(F)c2c-3ccc(OCC)c2F)cc1F

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CACNA1C Q13936 1/20 0.36
FFAR1 O14842 12/20 0.36
PPARD Q03181 4/20 0.34
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
MAOB P27338 2/20 0.32
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
GABRA1 P14867 2/20 0.31
GABRB2 P47870 2/20 0.31
PARP14 Q460N5 1/20 0.31
PARP10 Q53GL7 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
SCHEMBL10019684 0.92 FFAR1 (0.40) CACNA1CFFAR1PPARD
SCHEMBL10020017 0.89 FFAR1 (0.39) CACNA1CFFAR1PPARD
SCHEMBL10019660 0.89 FFAR1 (0.35) CACNA1CFFAR1PPARDPDCD1CD274
SCHEMBL10020181 0.89 CACNA1C (0.39) CACNA1CFFAR1PPARDMAOB
SCHEMBL10020026 0.89 CACNA1C (0.34) CACNA1CFFAR1PPARDFFAR4
SCHEMBL10020006 0.88 FFAR4 (0.35) CACNA1CFFAR1FFAR4MAOBGABRA1
SCHEMBL10019658 0.87 CTSL (0.39) FFAR4CTSLCTSSCTSKGABRA1
SCHEMBL10020013 0.87 CACNA1C (0.39) CACNA1CFFAR1PPARDFFAR4MAOB
SCHEMBL10020131 0.86 CTSL (0.40) FFAR4CTSLCTSSCTSKGABRA1
SCHEMBL10019549 0.86 CTSL (0.40) CTSLCTSSCTSKGABRA1GABRB2

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