SCHEMBL22035307

SCHEMBL22035307

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

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
KDM5A P29375 1/20 0.32
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP8 P22894 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31
DNM1 Q05193 1/20 0.31
SIGMAR1 Q99720 1/20 0.30
GGPS1 O95749 1/20 0.30
FDPS P14324 1/20 0.30
AGTR1 P30556 1/20 0.30
OPRM1 P35372 1/20 0.30
PDE3A Q14432 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
SCHEMBL21324002 0.92 CES2 (0.31) CES2CA12CA1CA2CA9
SCHEMBL22907293 0.92 CES2 (0.31) CES2CA12CA1CA2CA9
SCHEMBL27341113 0.89 CES2 (0.33) CES2CA12CA1CA2CA9
SCHEMBL20115513 0.86 CES2 (0.36) CES2CA12CA1CA2CA9
SCHEMBL20628161 0.86 CA12 (0.37) CES2CA12CA1CA2CA9
SCHEMBL24835898 0.84 CA12 (0.35) CA12CA1CA2CA9KDM5A
SCHEMBL24709510 0.82 CA12 (0.34) CES2CA12CA1CA2CA9
SCHEMBL20778802 0.81 CA12 (0.33) CES2CA12CA1CA2CA9
SCHEMBL23766685 0.80 CA12 (0.37) CES2CA12CA1CA2CA9
SCHEMBL24836047 0.80 CA12 (0.36) CA12CA1CA2CA9KDM5A

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-20230364223-A1 CORONAVIRUS VACCINE CureVac SE (DE) 2023-11-16 US disclosed
US-20220133908-A1 CODING RNA ADMINISTERED INTO THE SUPRACHOROIDAL SPACE IN THE TREATMENT OF OPHTHALMIC DISEASES CUREVAC AG (DE) 2022-05-05 US disclosed
US-20210198649-A1 NOVEL NUCLEIC ACID MOLECULES CUREVAC AG (DE) 2021-07-01 US disclosed
US-20200163878-A1 LIPID NANOPARTICLE MRNA VACCINES CureVac SE (DE) 2020-05-28 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 (4 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-20220133908-A1 CODING RNA ADMINISTERED INTO THE SUPRACHOROIDAL SPACE IN THE TREATMENT OF OPHTHALMIC DISEASES MTREX, NSUN3, SYNCRIP CES2 2524/4885CA12 1595/4885CA1 3276/4885
US-20210198649-A1 NOVEL NUCLEIC ACID MOLECULES TLR9, MICA, HLA-DRB1 CES2 4787/4885CA12 725/4885CA1 1805/4885
US-20230364223-A1 CORONAVIRUS VACCINE ACE2, LNPEP, ACE CES2 2791/4885CA12 1113/4885CA1 4089/4885
US-20200163878-A1 LIPID NANOPARTICLE MRNA VACCINES RNMT, PLIN3, SARNP CES2 4392/4885CA12 1306/4885CA1 2186/4885

“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.