SCHEMBL10012904

SCHEMBL10012904

COC(=O)OC(C(=O)OC)C(OC(=O)OC)C(=O)OC

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
CA14 Q9ULX7 2/20 0.37
ALDH1A1 P00352 4/20 0.35
CA12 O43570 1/20 0.34
KMT2A Q03164 1/20 0.34
ABCB1 P08183 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.31
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL10011167 0.80 ALDH1A1 (0.47) SMN1; SMN2CA14ALDH1A1CA12KMT2A
SCHEMBL10012920 0.79 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL10012524 0.79 ALDH1A1 (0.48) ALDH1A1KMT2ATSHR
SCHEMBL10011638 0.77 SMN1; SMN2 (0.43) SMN1; SMN2CA14ALDH1A1CA12KMT2A
SCHEMBL10011913 0.76 TDP1 (0.38) SMN1; SMN2ALDH1A1KMT2AABCB1TSHR
SCHEMBL10011123 0.76 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL18417201 0.75 SMN1; SMN2 (0.55) SMN1; SMN2CA14ALDH1A1CA12KMT2A
SCHEMBL9885889 0.75 SMN1; SMN2 (0.55) SMN1; SMN2CA14ALDH1A1CA12KMT2A
SCHEMBL18417202 0.75 SMN1; SMN2 (0.55) SMN1; SMN2CA14ALDH1A1CA12KMT2A
SCHEMBL10012464 0.74 SMN1; SMN2 (0.44) SMN1; SMN2CA14ALDH1A1CA12KMT2A

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 SMN1; SMN2 4063/4885CA14 247/4885ALDH1A1 2965/4885

“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.