SCHEMBL3883012

SCHEMBL3883012

Cc1ccc(-c2cc(P(=O)(O)c3ccc(C)cc3)ccc2C)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
TSHR P16473 1/20 0.62
GAA P10253 2/20 0.43
HPGD P15428 1/20 0.39
MAPK14 Q16539 4/20 0.38
PTPN5 P54829 1/20 0.36
PON1 P27169 1/20 0.36
S1PR4 O95977 2/20 0.35
LDHA P00338 1/20 0.34
LDHB P07195 1/20 0.34
FBP1 P09467 1/20 0.34
FDPS P14324 1/20 0.33
ESRRA P11474 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
PTGS2 P35354 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
MMP8 P22894 1/20 0.33

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
SCHEMBL10110952 0.81 LMNA (0.44) LMNATSHRGAAHPGDMAPK14
SCHEMBL339572 0.79 LMNA (1.00) LMNATSHRGAAHPGDCA12
SCHEMBL968908 0.73 LMNA (0.56) LMNATSHRGAAHPGD
SCHEMBL1046094 0.72 ESRRA (0.46) HPGDMAPK14S1PR4ESRRAADORA3
SCHEMBL5605189 0.71 TSHR (0.82) LMNATSHRGAAHPGDPTGS2
SCHEMBL4127150 0.70 CA12 (0.42) LMNATSHRHPGDPTPN5S1PR4
SCHEMBL11809603 0.69 LMNA (0.62) LMNATSHRGAAHPGDPTPN5
SCHEMBL30445989 0.68 ESRRA (0.46) HPGDS1PR4ESRRAADORA3
SCHEMBL139182 0.68 ESRRA (0.46) HPGDS1PR4ESRRAADORA3
SCHEMBL2744390 0.68 GRIK1 (0.59) TSHRGAAHPGDMAPK14

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed