SCHEMBL3469587

SCHEMBL3469587

COC(C(C)=O)P(=O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL9081756 0.79 SLC1A3 (0.36) CA12CA1CA2MMP1MMP2
SCHEMBL14529792 0.77 CA4 (0.35) CA12CA1CA2MMP1MMP2
SCHEMBL2978564 0.77 LMNA (0.38) ALDH1A1
SCHEMBL19379352 0.77 TSHR (0.42) ALDH1A1
SCHEMBL2978566 0.75 MMP1 (0.34) CA12CA1CA2MMP1MMP2
SCHEMBL20333341 0.73 MMP2 (0.37) CA12CA1CA2MMP1MMP2
SCHEMBL29210833 0.73 ENPP2 (0.30)
SCHEMBL19379096 0.72 ALDH1A1 (0.37) ALDH1A1
SCHEMBL2990006 0.70 CYP3A4 (0.39)
SCHEMBL2990009 0.70 LAP3 (0.37) CA12CA1CA2MMP1MMP2

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
EP-2237358-B1 Nonaqueous electrolyte battery MITSUBISHI CHEM CORP (JP) 2015-08-12 EP disclosed
US-20120156557-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-06-21 US disclosed
EP-2237358-A1 Nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2010-10-06 EP disclosed
EP-2128923-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY Mitsubishi Chemical Corporation (JP) 2009-12-02 EP disclosed