SCHEMBL23766685

SCHEMBL23766685

CCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)C(=O)COC(C)(C)CO

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.37
CA1 P00915 3/20 0.37
CA9 Q16790 3/20 0.37
CA2 P00918 1/20 0.37
ZDHHC20 Q5W0Z9 2/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
MGLL Q99685 1/20 0.34
CES2 O00748 2/20 0.33
KDM5A P29375 2/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP8 P22894 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
KDM4C Q9H3R0 1/20 0.32
PHF8 Q9UPP1 1/20 0.32

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
SCHEMBL20628161 0.87 CA12 (0.37) CA12CA1CA9CA2ZDHHC20
SCHEMBL25924428 0.86 CA12 (0.36) CA12CA1CA9CA2ZDHHC20
SCHEMBL24557245 0.84 CA12 (0.35) CA12CA1CA9CA2ZDHHC20
SCHEMBL24709510 0.83 CA12 (0.34) CA12CA1CA9CA2ZDHHC20
SCHEMBL20778802 0.82 CA12 (0.33) CA12CA1CA9CA2ZDHHC20
SCHEMBL20115513 0.82 CES2 (0.36) CA12CA1CA9CA2ZDHHC20
SCHEMBL27341113 0.82 CES2 (0.33) CA12CA1CA9CA2ZDHHC20
SCHEMBL22035307 0.80 CES2 (0.32) CA12CA1CA9CA2ZDHHC20
SCHEMBL21324002 0.78 CES2 (0.31) CA12CA1CA9CA2CES2
SCHEMBL22907293 0.78 CES2 (0.31) CA12CA1CA9CA2CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230287088-A1 BINDING AGENTS FOR CORONAVIRUS S PROTEIN BioNTech SE (DE) 2023-09-14 US disclosed
US-20210251898-A1 LIPID NANOPARTICLE MRNA VACCINES CUREVAC AG (DE) 2021-08-19 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 (2 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-20230287088-A1 BINDING AGENTS FOR CORONAVIRUS S PROTEIN SARS1, CD2BP2, RBM3 CA12 2671/4885CA1 3712/4885CA9 3872/4885
US-20210251898-A1 LIPID NANOPARTICLE MRNA VACCINES RNMT, PLIN3, SARNP CA12 1306/4885CA1 2186/4885CA9 1876/4885

“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.