SCHEMBL777249

SCHEMBL777249

Cc1ccccc1C(=O)CCCC(c1ccccc1)P(=O)(O)O

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 4/20 0.49
ERCC5 P28715 1/20 0.43
FEN1 P39748 1/20 0.43
CTNNB1 P35222 3/20 0.42
WNT3A P56704 3/20 0.42

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
SCHEMBL778072 0.83 ACP3 (0.49) ACP3ERCC5FEN1CTNNB1WNT3A
SCHEMBL779388 0.82 CTNNB1 (0.44) ERCC5FEN1CTNNB1WNT3A
SCHEMBL778565 0.81 ACP3 (0.49) ACP3
SCHEMBL3889174 0.76 ACP3 (0.60) ACP3
SCHEMBL1246417 0.75 ACP3 (0.62) ACP3
SCHEMBL7914414 0.74 ERCC5 (0.58) ERCC5FEN1CTNNB1WNT3A
SCHEMBL29634736 0.74 ERCC5 (0.58) ERCC5FEN1CTNNB1WNT3A
SCHEMBL777250 0.73 ACP3 (0.42) ACP3ERCC5FEN1
SCHEMBL5035396 0.73 ACP3 (0.64) ACP3
SCHEMBL779065 0.72 ACP3 (0.50) ACP3ERCC5FEN1

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