SCHEMBL777515

SCHEMBL777515

O=P(O)(O)C(Cc1ccccc1F)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 3/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
RIPK1 Q13546 1/20 0.37
HPGD P15428 1/20 0.37
TAAR1 Q96RJ0 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
PTPN1 P18031 1/20 0.35
LAP3 P28838 3/20 0.35
ANPEP P15144 1/20 0.35
LMNA P02545 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL779493 0.87 PPARG (0.36) PPARGPPARARIPK1HPGDTAAR1
SCHEMBL778210 0.84 TAAR1 (0.42) ACP3RIPK1TAAR1TRPV1ANPEP
SCHEMBL9849575 0.76 ALDH1A1 (0.40) PPARGPPARAHPGDTAAR1ALDH1A1
SCHEMBL777639 0.73 ACP3 (0.62) ACP3PPARGPPARA
SCHEMBL776767 0.73 TAAR1 (0.38) ACP3RIPK1TAAR1TRPV1ANPEP
SCHEMBL15149739 0.73 TAAR1 (0.42) PPARGPPARARIPK1TAAR1LMNA
SCHEMBL4287643 0.72 ACP3 (0.55) ACP3HPGDTAAR1LMNAALDH1A1
SCHEMBL777704 0.72 DPP4 (0.38) ACP3PPARGPPARAHPGDTAAR1
SCHEMBL779297 0.70 DPP4 (0.37) PPARGPPARAHPGDTAAR1LAP3
SCHEMBL776712 0.68 KMT2A (0.43) LMNAALDH1A1

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