SCHEMBL777301

SCHEMBL777301

O=P(O)(O)C(c1ccccc1F)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
ACP3 P15309 1/20 0.41
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
PYGL P06737 1/20 0.36
EPHX1 P07099 1/20 0.36
CYP3A4 P08684 2/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP2C9 P11712 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HIF1A Q16665 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL776713 0.81 KMT2A (0.41) KMT2AMEN1ACP3NPC1RAB9A
SCHEMBL779249 0.81 KMT2A (0.36) KMT2AMEN1ACP3NPC1RAB9A
SCHEMBL777508 0.76 KMT2A (0.39) KMT2AMEN1ACP3NPC1RAB9A
SCHEMBL2786219 0.73 KMT2A (0.48) KMT2AMEN1NPC1RAB9AEPHX1
SCHEMBL776712 0.72 KMT2A (0.43) KMT2AMEN1NPC1RAB9AEPHX1
SCHEMBL14873255 0.71 KMT2A (0.46) KMT2AMEN1NPC1RAB9AEPHX1
SCHEMBL778849 0.70 ACP3 (0.47) KMT2AMEN1ACP3CYP3A4CES2
SCHEMBL20217301 0.69 KMT2A (0.43) KMT2AMEN1NPC1RAB9AEPHX1
SCHEMBL9437111 0.69 KMT2A (0.47) KMT2AMEN1NPC1RAB9AEPHX1
SCHEMBL777105 0.69 ACP3 (0.36) KMT2AMEN1ACP3CYP3A4CES2

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 7 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-20120177988-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-07-12 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