SCHEMBL10020139

SCHEMBL10020139

CCCc1ccc(COc2ccc3c(c2F)C(F)C(F)c2c-3ccc(OCC)c2F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRG P48443 2/20 0.39
GABRA1 P14867 2/20 0.35
GABRB2 P47870 2/20 0.35
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
NAAA Q02083 1/20 0.34
FFAR1 O14842 2/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
ABCB1 P08183 2/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
VDR P11473 1/20 0.32
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
CALM1 P0DP23 1/20 0.32
HTR6 P50406 1/20 0.32

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
SCHEMBL19621994 0.92 ABCB1 (0.39) RXRGGABRA1GABRB2FFAR1ABCB1
SCHEMBL10020154 0.91 GABRA1 (0.38) RXRGGABRA1GABRB2NAAACALM1
SCHEMBL10020037 0.90 GABRA1 (0.37) GABRA1GABRB2NAAAHCRTR1HCRTR2
SCHEMBL10020140 0.89 RXRG (0.36) RXRGRXRARXRBABCB1VDR
SCHEMBL10020033 0.89 GABRA1 (0.38) RXRGGABRA1GABRB2NAAAHCRTR1
SCHEMBL10020161 0.88 RXRG (0.36) RXRGGABRA1GABRB2RXRARXRB
SCHEMBL10020164 0.88 KDM1A (0.40) NAAAFFAR1HCRTR1HCRTR2PPARG
SCHEMBL10020020 0.87 GABRA1 (0.36) GABRA1GABRB2NAAAHCRTR1HCRTR2
SCHEMBL10020166 0.87 RXRG (0.35) RXRGRXRARXRBFFAR1CTSL
SCHEMBL10019938 0.86 KDM1A (0.35) GABRA1GABRB2FFAR1CALM1KDM1A

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