SCHEMBL32665835

SCHEMBL32665835

[N-]=[N+]=NCC(=O)NCC(=O)NCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
ALDH1A1 P00352 3/20 0.33
CTH P32929 1/20 0.32
ITGB1 P05556 1/20 0.32
ITGA5 P08648 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31
FAAH O00519 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PTGS2 P35354 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PTPN1 P18031 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
SCHEMBL13653564 0.96 CA2 (0.41) CA2CA9ALDH1A1CTHITGB1
SCHEMBL27463134 0.79
SCHEMBL22688014 0.79 CA2 (0.45) CA2CA9
SCHEMBL27401146 0.76 SMN1; SMN2 (0.35) CA2CA9ALDH1A1FAAHMAPT
Trifluoroacetic Acid SCHEMBL29430498 0.74 CA2 (0.39) CA2CA9
SCHEMBL27547173 0.74
SCHEMBL21546112 0.74
SCHEMBL27463967 0.74
SCHEMBL21611916 0.73 OTC (0.48) CA2CA9TDP1
SCHEMBL21611915 0.73 OTC (0.48) CA2CA9TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12533443-B2 Quenched coating ORIGINAL G B.V. (NL) 2026-01-27 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-12533443-B2 Quenched coating VIP, CD14, LNPEP CA2 1171/4885CA9 463/4885ALDH1A1 2645/4885

“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.