SCHEMBL778603

SCHEMBL778603

Cc1ccc(C(=O)CC(c2ccccc2)P(=O)(O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MEN1 O00255 1/20 0.51
ACP3 P15309 3/20 0.49
POLB P06746 2/20 0.47
LMNA P02545 3/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
TP53 P04637 1/20 0.44
HSD11B1 P28845 1/20 0.44

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
SCHEMBL778565 0.83 ACP3 (0.49) KMT2ANPC1RAB9AMEN1ACP3
SCHEMBL2224882 0.79 FFAR1 (0.46) ACP3
SCHEMBL778072 0.79 ACP3 (0.49) ACP3
SCHEMBL29110675 0.78 KMT2A (0.58) KMT2ANPC1RAB9AMEN1POLB
SCHEMBL26820508 0.78 KMT2A (0.58) KMT2ANPC1RAB9AMEN1POLB
SCHEMBL11297322 0.77 ACP3 (0.61) ACP3
SCHEMBL8775505 0.76 ALDH1A1 (0.53) KMT2ANPC1RAB9AMEN1POLB
SCHEMBL11204001 0.76 KMT2A (0.56) KMT2ANPC1RAB9AMEN1POLB
SCHEMBL3896707 0.76 ACP3 (0.77) KMT2AMEN1ACP3
SCHEMBL12266805 0.76 KMT2A (0.56) KMT2ANPC1RAB9AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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