SCHEMBL10010107

SCHEMBL10010107

C#CCOC(=O)OC(C)C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.38
NPC1 O15118 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
TSHR P16473 1/20 0.31
CA14 Q9ULX7 1/20 0.31
SLC1A3 P43003 1/20 0.30
SLC1A2 P43004 1/20 0.30
SLC1A1 P43005 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
SCHEMBL10011944 0.89 NPC1 (0.36) ACHENPC1L3MBTL1ZDHHC20TSHR
SCHEMBL10009409 0.87 ACHE (0.36) ACHENPC1L3MBTL1ZDHHC20TSHR
SCHEMBL10476524 0.87 ACHE (0.36) ACHENPC1L3MBTL1ZDHHC20TSHR
SCHEMBL10012518 0.84 ALDH1A1 (0.37) NPC1L3MBTL1ZDHHC20TSHR
SCHEMBL10476487 0.83 SLC1A3 (0.38) NPC1TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL10010595 0.83 ACHE (0.39) ACHENPC1SMN1; SMN2L3MBTL1ZDHHC20
SCHEMBL10476492 0.83 SLC1A3 (0.38) NPC1TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL10011143 0.83 ACHE (0.32) ACHENPC1TSHR
SCHEMBL577188 0.82
SCHEMBL10012563 0.81 NPC1 (0.32) NPC1

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 ACHE 4495/4885NPC1 2731/4885SMN1; SMN2 4063/4885

“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.