SCHEMBL777792

SCHEMBL777792

Cc1ccc(C(=O)c2c(-c3ccccc3)cccc2P(=O)(O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.44
TDP1 Q9NUW8 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 1/20 0.44
AKR1C3 P42330 1/20 0.43
PTK2B Q14289 2/20 0.43
RXFP1 Q9HBX9 1/20 0.43
ALDH1A1 P00352 5/20 0.42
CNR2 P34972 1/20 0.42
SRD5A2 P31213 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
MAPT P10636 6/20 0.39
HPGD P15428 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
HTT P42858 2/20 0.39
APAF1 O14727 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL779422 0.83 MYC (0.43) LMNAL3MBTL1PTK2BRXFP1ALDH1A1
SCHEMBL779625 0.80 ALDH1A1 (0.48) LMNATDP1L3MBTL1AKR1C3PTK2B
SCHEMBL6911946 0.79 AKR1C3 (0.60) LMNATDP1L3MBTL1MAPK1AKR1C3
SCHEMBL3895587 0.78 PTK2B (0.42) LMNATDP1L3MBTL1MAPK1PTK2B
SCHEMBL778488 0.75 AKR1C3 (0.41) LMNATDP1L3MBTL1MAPK1AKR1C3
SCHEMBL28116437 0.73 AKR1C3 (0.66) LMNATDP1L3MBTL1MAPK1AKR1C3
SCHEMBL29066920 0.72 ALDH1A1 (0.67) LMNATDP1L3MBTL1MAPK1AKR1C3
Phosphoric Acid SCHEMBL9637834 0.72 PTPN5 (0.47) LMNATDP1L3MBTL1MAPK1ALDH1A1
SCHEMBL29850685 0.72 LMNA (0.37) LMNAL3MBTL1PTK2BRXFP1ALDH1A1
SCHEMBL9742588 0.72 PTK2B (0.42) LMNAPTK2BRXFP1MAPTSMN1; SMN2

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