SCHEMBL21087526

SCHEMBL21087526

C1CCN(SCSN2CCCC2)C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.47
HRH3 Q9Y5N1 1/20 0.33
FBP1 P09467 2/20 0.32
KDM4A O75164 1/20 0.32
PHGDH O43175 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ALDH2 P05091 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
SCHEMBL21087584 0.96 MGLL (0.53) MGLLHRH3FBP1KDM4APHGDH
SCHEMBL19058030 0.81
SCHEMBL21087586 0.74 MGLL (0.55) MGLLPHGDHALDH1A1ALDH2
SCHEMBL22773554 0.72
SCHEMBL18583236 0.72
SCHEMBL23084778 0.69
SCHEMBL22296130 0.69
SCHEMBL18583119 0.67
SCHEMBL5965068 0.67 MGLL (0.92) MGLL
SCHEMBL10959852 0.67 MGLL (0.53) MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10615456-B2 Additive for nonaqueous electrolyte solutions, nonaqueous electrolyte solution and electricity storage device SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2020-04-07 US disclosed
US-10573929-B2 2020-02-25 US disclosed
US-20190181499-A1 ADDITIVE FOR NONAQUEOUS ELECTROLYTE SOLUTIONS, NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2019-06-13 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 (3 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-10615456-B2 Additive for nonaqueous electrolyte solutions, nonaqueous electrolyte solution and electricity storage device SLC9A1, SLC26A3, SCNN1A MGLL 3002/4885HRH3 481/4885FBP1 2797/4885
US-10573929-B2 SLC26A3, SLC9A1, CLIC1 MGLL 3319/4885HRH3 495/4885FBP1 1956/4885
US-20190181499-A1 ADDITIVE FOR NONAQUEOUS ELECTROLYTE SOLUTIONS, NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE SLC9A1, SLC26A3, SCNN1A MGLL 3002/4885HRH3 481/4885FBP1 2797/4885

“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.