SCHEMBL10019987

SCHEMBL10019987

C=CCCc1ccc(-c2ccc3c(c2F)C(F)(F)C(F)(F)c2c-3ccc(OCC)c2F)c(F)c1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.32
GABRB2 P47870 3/20 0.32
CALM1 P0DP23 2/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30
LMNA P02545 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
SCHEMBL10020113 0.91 PKM (0.36) GABRA1GABRB2CALM1LMNA
SCHEMBL10020021 0.89 GABRA1 (0.33) GABRA1GABRB2
SCHEMBL10019978 0.88 GABRA1 (0.37) GABRA1GABRB2CALM1PTGS1PTGS2
SCHEMBL10020015 0.87 PKM (0.33) GABRA1GABRB2CALM1
SCHEMBL10019960 0.87 GABRA1 (0.35) GABRA1GABRB2LMNA
SCHEMBL10020123 0.86 GABRA1 (0.31) GABRA1GABRB2
SCHEMBL10020032 0.85 GABRA1 (0.32) GABRA1GABRB2CALM1
SCHEMBL10019935 0.85 GAA (0.35) GABRA1GABRB2CALM1LMNA
SCHEMBL15257988 0.85 HCRTR1 (0.32) GABRA1GABRB2
SCHEMBL10019919 0.85 PDE5A (0.32) GABRA1GABRB2PTGS1PTGS2

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