SCHEMBL10020132

SCHEMBL10020132

CCCc1ccc(C(F)(F)Oc2ccc3c(c2F)C(F)C(F)c2c-3ccc(OCC)c2F)cc1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 6/20 0.34
HCRTR2 O43614 6/20 0.34
GABRA1 P14867 2/20 0.32
GABRB2 P47870 2/20 0.32
PSMB5 P28074 1/20 0.31
FFAR4 Q5NUL3 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL10020148 0.88 HCRTR1 (0.32) HCRTR1HCRTR2
SCHEMBL19622010 0.87 HCRTR1 (0.33) HCRTR1HCRTR2
SCHEMBL10020163 0.87 L3MBTL1 (0.40) HCRTR1HCRTR2CYP1A2CYP2C9CYP2C19
SCHEMBL10020150 0.84 HCRTR1 (0.32) HCRTR1HCRTR2GABRA1GABRB2CYP1A2
SCHEMBL15257993 0.84 HCRTR1 (0.38) HCRTR1HCRTR2
SCHEMBL10020093 0.84 HCRTR1 (0.35) HCRTR1HCRTR2GABRA1GABRB2
SCHEMBL10019938 0.84 KDM1A (0.35) GABRA1GABRB2FFAR4CYP2C9CYP2C19
SCHEMBL10020152 0.83 KDM1A (0.38) HCRTR1HCRTR2CYP1A2CYP2C9CYP2C19
SCHEMBL10019989 0.83 FFAR4 (0.39) GABRA1GABRB2FFAR4
SCHEMBL10020144 0.82 FAAH (0.33)

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