SCHEMBL3896709

SCHEMBL3896709

Cc1ccc(C(CP(=O)(O)O)c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 7/20 0.49
SRC P12931 1/20 0.48
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
LMNA P02545 1/20 0.45
CACNA2D1 P54289 1/20 0.42
CACNA1B Q00975 1/20 0.42
CACNB1 Q02641 1/20 0.42
CACNA1C Q13936 1/20 0.42
CASR P41180 1/20 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
SCHEMBL3883725 0.94 CA12 (0.46) ACP3LMNA
SCHEMBL875769 0.88 SRC (0.60) ACP3SRC
SCHEMBL16859931 0.81 ACP3 (0.71) ACP3SRCLMNA
SCHEMBL16859930 0.80 ACP3 (0.65) ACP3SRC
SCHEMBL3883994 0.80 HTR2A (0.50) ACP3SRCCNR1CNR2CASR
SCHEMBL3884599 0.79 ACP3 (0.65) ACP3SRC
SCHEMBL778604 0.77 LMNA (0.51) ACP3SRCLMNA
SCHEMBL3889193 0.77 ACHE (0.50) LMNA
SCHEMBL28002095 0.76 CA12 (0.43) LMNA
SCHEMBL779192 0.75 CA12 (0.46) ACP3SRCLMNA

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 3 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-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 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