SCHEMBL3884843

SCHEMBL3884843

Cc1cccc(C(c2cccc(C)c2)P(=O)(O)O)c1

nearest known ligand 0.89

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACP3 P15309 10/20 0.89
▸ PGK1 P00558 4/20 0.48
▸ PGK2 P07205 4/20 0.48
▸ ACHE P22303 1/20 0.42
▸ SRC P12931 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
SCHEMBL18606568 0.84 ACP3 (0.66) ACP3PGK1PGK2ACHESRC
SCHEMBL11082514 0.82 PGK1 (0.74) ACP3PGK1PGK2ACHESRC
SCHEMBL3893653 0.82 ACP3 (0.64) ACP3PGK1PGK2ACHESRC
SCHEMBL16859930 0.79 ACP3 (0.65) ACP3PGK1PGK2SRC
SCHEMBL21616521 0.78 ACP3 (0.58) ACP3PGK1PGK2
SCHEMBL3888442 0.78 ACP3 (0.58) ACP3PGK1PGK2ACHESRC
Methyl Phosphonate SCHEMBL9619515 0.77 ACP3 (0.57) ACP3PGK1PGK2ACHE
SCHEMBL778799 0.76 ACP3 (0.56) ACP3PGK1PGK2
SCHEMBL16859931 0.76 ACP3 (0.71) ACP3SRC
M-Xylene SCHEMBL867616 0.75 ACHE (0.67) ACP3ACHE

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
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