SCHEMBL778563

SCHEMBL778563

C=CC(CCCc1ccccc1F)P(=O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.39
MPO P05164 3/20 0.38
ANPEP P15144 2/20 0.36
ERAP1 Q9NZ08 2/20 0.36
ERAP2 Q6P179 1/20 0.36
ACP3 P15309 1/20 0.35
SLC6A4 P31645 1/20 0.35
AOC3 Q16853 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
DAO P14920 1/20 0.33

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
SCHEMBL777704 0.82 DPP4 (0.38) TAAR1ANPEPACP3SLC6A4
SCHEMBL777836 0.81 TAAR1 (0.37) TAAR1MPOANPEPERAP1ERAP2
SCHEMBL777070 0.75 ACP3 (0.60) TAAR1MPOANPEPERAP1ERAP2
SCHEMBL776767 0.73 TAAR1 (0.38) TAAR1MPOANPEPERAP1ERAP2
SCHEMBL777507 0.70 C3AR1 (0.42) TAAR1
SCHEMBL778210 0.69 TAAR1 (0.42) TAAR1MPOANPEPERAP1ERAP2
SCHEMBL30660239 0.68 TAAR1 (0.68) TAAR1MPOSLC6A4AOC3DAO
SCHEMBL779297 0.68 DPP4 (0.37) TAAR1ANPEP
SCHEMBL8063273 0.68 TAAR1 (0.52) TAAR1MPOSLC6A4AOC3DAO
SCHEMBL14668128 0.68 TAAR1 (0.52) TAAR1MPOSLC6A4AOC3

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