SCHEMBL10019934

SCHEMBL10019934

CCCC1CCC(COc2ccc3c(c2F)C(F)C(F)c2c-3ccc(OCC)c2F)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.37
HTR2C P28335 6/20 0.35
HTR2A P28223 4/20 0.35
HTR2B P41595 3/20 0.35
PTGDR2 Q9Y5Y4 4/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
SSTR5 P35346 1/20 0.32
KCNH2 Q12809 1/20 0.32
BRD4 O60885 2/20 0.31
KDM1A O60341 2/20 0.31
HPGD P15428 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
SCHEMBL10019614 0.89 RIPK1 (0.36) RIPK1HTR2CHTR2AHTR2BPTGDR2
SCHEMBL1311479 0.88 RIPK1 (0.38) RIPK1HTR2CHTR2AHTR2BPTGDR2
SCHEMBL28700888 0.88 RIPK1 (0.42) RIPK1HTR2CHTR2AHTR2BSSTR5
SCHEMBL12366402 0.88 RIPK1 (0.42) RIPK1HTR2CHTR2AHTR2BSSTR5
SCHEMBL15445797 0.88 RIPK1 (0.42) RIPK1HTR2CHTR2AHTR2BSSTR5
SCHEMBL10019874 0.88 CYP2C9 (0.32) ALOX5APFEN1
SCHEMBL10019940 0.88 HTR2A (0.35) RIPK1HTR2CHTR2AHTR2BPTGDR2
SCHEMBL10019947 0.87 RIPK1 (0.34) RIPK1HTR2CHTR2AHTR2BPTGDR2
SCHEMBL10019834 0.87 CTSL (0.31)
SCHEMBL10020169 0.85 HCRTR1 (0.31)

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