SCHEMBL21087585

SCHEMBL21087585

FC(F)(SN1CCOCC1)C(F)(F)SN1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.50
FAAH O00519 1/20 0.31
PHGDH O43175 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALDH2 P05091 1/20 0.31
PDK1 Q15118 1/20 0.31
PDK2 Q15119 1/20 0.31
PDK3 Q15120 1/20 0.31

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
SCHEMBL21087653 0.84 MGLL (0.50) MGLLFAAHPHGDHALDH1A1ALDH2
SCHEMBL29003977 0.74 MGLL (0.50) MGLLFAAHPHGDHALDH1A1ALDH2
Dithiodimorpholine SCHEMBL137538 0.67 MGLL (1.00) MGLLFAAHPHGDHALDH1A1ALDH2
SCHEMBL4059942 0.67 MGLL (0.65) MGLLFAAHPHGDHALDH1A1ALDH2
Dithiodimorpholine SCHEMBL29262652 0.65 MGLL (0.93) MGLLFAAHPHGDHALDH1A1ALDH2
Dithiodimorpholine SCHEMBL20769316 0.65 MGLL (0.93) MGLLFAAHPHGDHALDH1A1ALDH2
SCHEMBL22563746 0.63 MGLL (0.50) MGLLFAAHPHGDHALDH1A1ALDH2
SCHEMBL21088000 0.63 MGLL (0.50) MGLLFAAHPHGDHALDH1A1ALDH2
SCHEMBL288726 0.63 MGLL (0.36) MGLLALDH1A1
SCHEMBL7171952 0.63

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 3002/4885FAAH 1974/4885PHGDH 721/4885
US-10573929-B2 SLC26A3, SLC9A1, CLIC1 MGLL 3319/4885FAAH 1641/4885PHGDH 1036/4885
US-20190181499-A1 ADDITIVE FOR NONAQUEOUS ELECTROLYTE SOLUTIONS, NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE SLC9A1, SLC26A3, SCNN1A MGLL 3002/4885FAAH 1974/4885PHGDH 721/4885

“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.