SCHEMBL10012441

SCHEMBL10012441

COC(=O)CCC(OS(=O)(=O)c1ccccc1)C(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.44
CA9 Q16790 4/20 0.44
CA7 P43166 3/20 0.44
CA14 Q9ULX7 3/20 0.44
CA2 P00918 2/20 0.42
CA1 P00915 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
ALOX5 P09917 2/20 0.40
AKT1 P31749 1/20 0.40
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MITF O75030 1/20 0.37
S1PR4 O95977 1/20 0.37
HPGD P15428 1/20 0.37
S1PR1 P21453 1/20 0.37

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
SCHEMBL10012341 0.88 CA12 (0.44) CA12CA9CA2CA1KMT2A
SCHEMBL10011782 0.86 KMT2A (0.43) CA12CA9CA7CA14CA2
SCHEMBL7067274 0.83 KMT2A (0.41) CA12CA9CA7CA14CA2
SCHEMBL7972978 0.81 KMT2A (0.40) CA12CA9CA7CA14CA2
SCHEMBL7972944 0.80 KMT2A (0.39) CA12CA9CA7CA14CA2
SCHEMBL10010294 0.76 ALDH1A1 (0.43) CA12CA9CA14CA2CA1
SCHEMBL10011245 0.76 KMT2A (0.47) CA2CA1KMT2AMEN1SMN1; SMN2
SCHEMBL10010227 0.76 TSHR (0.41) CA12CA9CA7CA14CA2
SCHEMBL10012235 0.76 KMT2A (0.47) CA12CA9CA2CA1KMT2A
SCHEMBL9703092 0.75 CA12 (0.46) CA12CA9CA7CA14CA2

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-9130244-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2015-09-08 US disclosed
EP-2908376-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2015-08-19 EP disclosed
EP-2479831-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2012-07-25 EP disclosed
US-20120171581-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2012-07-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120171581-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME SLC8A1, OR10J3, SLC8B1 CA12 270/4885CA9 236/4885CA7 39/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.