SCHEMBL776727

SCHEMBL776727

COP(=O)(C=CF)Oc1ccccc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KDM4E B2RXH2 2/20 0.42
POLB P06746 1/20 0.42
HTT P42858 3/20 0.40
GAA P10253 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
XBP1 P17861 1/20 0.40
MAPK1 P28482 1/20 0.40
NPC1 O15118 1/20 0.39
NFE2L2 Q16236 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36

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
SCHEMBL29468663 0.90 LMNA (0.44) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL776879 0.90 LMNA (0.44) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL777684 0.78 L3MBTL1 (0.43) LMNAKDM4EHTTMEN1KMT2A
SCHEMBL31306469 0.75 LMNA (0.50) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL777993 0.74
SCHEMBL4126230 0.74 LMNA (0.45) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL1471613 0.74 LMNA (0.49) LMNACYP1A2CYP3A4CYP2D6CYP2C9
Nitrogen SCHEMBL28055525 0.73 HTT (0.48) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL1471615 0.71 LMNA (0.46) LMNACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL4118787 0.71 LMNA (0.53) LMNACYP1A2CYP3A4CYP2D6CYP2C9

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