SCHEMBL779598

SCHEMBL779598

CCc1ccccc1P(=O)(O)c1ccccc1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
RIPK1 Q13546 2/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
PSIP1 O75475 1/20 0.36
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PTPN5 P54829 1/20 0.35
GAA P10253 2/20 0.35
PKM P14618 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL20526222 0.89 GABRA1 (0.44) GABRA1GABRB2ALDH1A1PTPN5NPC1
SCHEMBL779588 0.85 HDAC3 (0.38) ALDH1A1SMN1; SMN2
SCHEMBL781245 0.81 PGK1 (0.35) LMNARIPK1ALDH1A1MAPK1PTPN5
SCHEMBL18486710 0.79 FDPS (0.45) GABRA1GABRB2ALDH1A1MAPTSMN1; SMN2
SCHEMBL776973 0.78 ACHE (0.46) LMNAMEN1KMT2ASMN1; SMN2HPGD
Hydrogen Peroxide SCHEMBL8527172 0.78 CFTR (0.45) MEN1ALDH1A1KMT2AHTTGAA
SCHEMBL8585005 0.78 CFTR (0.45) MEN1ALDH1A1KMT2AHTTGAA
SCHEMBL344617 0.77 PTK2B (0.46) GABRA1GABRB2ALDH1A1PTPN5NPC1
SCHEMBL20526234 0.76 TSHR (0.39) GABRA1GABRB2MEN1ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL10824664 0.75 PTK2B (0.44) GABRA1GABRB2ALDH1A1PTPN5NPC1

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