SCHEMBL3890736

SCHEMBL3890736

Cc1ccccc1C(c1ccccc1C)(C(F)(F)F)P(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PGK1 P00558 5/20 0.47
▸ PGK2 P07205 5/20 0.47
▸ PTPN1 P18031 5/20 0.42
▸ ACP3 P15309 2/20 0.39
▸ PTPN5 P54829 3/20 0.38
▸ CDC14B O60729 1/20 0.38
▸ CDC14A Q9UNH5 1/20 0.38
▸ PTPRC P08575 1/20 0.36
▸ PDK1 Q15118 1/20 0.36
▸ PDK2 Q15119 1/20 0.36
▸ PDK3 Q15120 1/20 0.36
▸ PDK4 Q16654 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ ALOX12 P18054 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
SCHEMBL780813 0.79 PTPN1 (0.44) PGK1PGK2PTPN1ACP3PTPN5
SCHEMBL3884603 0.75 PGK1 (0.42) PGK1PGK2PTPN1ACP3PTPN5
SCHEMBL778974 0.72 PTPN1 (0.65) PGK1PGK2PTPN1ACP3PTPN5
SCHEMBL3738148 0.71 PGK1 (0.53) PGK1PGK2PTPN1PTPN5CDC14B
SCHEMBL1035151 0.70 PGK1 (0.39) PGK1PGK2PTPN1ACP3ALDH1A1
SCHEMBL16460266 0.70 PGK1 (0.39) PGK1PGK2PTPN1ACP3PTPN5
SCHEMBL777522 0.70 PTPN1 (0.52) PGK1PGK2PTPN1ACP3PTPN5
SCHEMBL5222166 0.70 SMN1; SMN2 (0.46) PDK1PDK2PDK3PDK4ALDH1A1
Phosphoric Acid SCHEMBL5874226 0.69 GABRA1 (0.39) PGK1PGK2PTPN1ACP3ALDH1A1
Phosphoric Acid SCHEMBL7178344 0.69 GABRA1 (0.44) PGK1PGK2ACP3PTPN5CDC14B

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12100809-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-24 — — US disclosed
US-20220149436-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2022-05-12 — — US disclosed
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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