SCHEMBL779578

SCHEMBL779578

COP(=O)(Oc1ccccc1F)C1CCCCC1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
GAA P10253 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
XBP1 P17861 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 3/20 0.35
NPC1 O15118 1/20 0.35
PDE4D Q08499 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
SCHEMBL29468626 0.93 LMNA (0.38) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL779455 0.93 LMNA (0.38) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL779484 0.83 L3MBTL1 (0.42) LMNAHTTNPSR1MEN1KMT2A
SCHEMBL575239 0.77
SCHEMBL4130809 0.76 LMNA (0.41) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL778348 0.73 L3MBTL1 (0.43) KDM4EHPGDTDP1L3MBTL1DPP4
SCHEMBL1471613 0.72 LMNA (0.49) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL31306469 0.70 LMNA (0.50) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL779521 0.70 LMNA (0.41) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL29468678 0.69 KMT2A (0.41) CYP1A2CYP3A4CYP2C19NPSR1MEN1

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
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-9343777-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-17 US disclosed
US-9252457-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-02 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-20120070731-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-03-22 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