SCHEMBL22688014

SCHEMBL22688014

[N-]=[N+]=NCC(=O)NCCNC(=O)CNC(=O)CN

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
TERT O14746 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
Trifluoroacetic Acid SCHEMBL29430498 0.90 CA2 (0.39) CA2CA9
SCHEMBL28901062 0.80 CA2 (0.50) CA2CA9
SCHEMBL32665835 0.79 CA2 (0.39) CA2CA9
SCHEMBL31413665 0.78 CA2 (0.38) CA2CA9
SCHEMBL20829940 0.77 CA2 (0.48) CA2CA9
SCHEMBL22688016 0.76 TDP1 (0.38) CA2CA9
SCHEMBL28099596 0.76 CA2 (0.47) CA2CA9
SCHEMBL23568449 0.75 CA2 (0.36) CA2CA9
SCHEMBL15057676 0.75 PAOX (0.47) CA2CA9
SCHEMBL21981211 0.74 CA2 (0.48) CA2CA9

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-20220409734-A1 ANTIBODY DRUG CONJUGATES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-12-29 US disclosed
EP-3965891-A1 ANTIBODY DRUG CONJUGATES Takeda Pharmaceutical Company Limited (JP) 2022-03-16 EP disclosed
CN-114173824-A Antibody drug conjugates 武田药品工业株式会社 2022-03-11 CN disclosed
WO-2020229982-A1 ANTIBODY DRUG CONJUGATES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-11-19 WO 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-20220409734-A1 ANTIBODY DRUG CONJUGATES STING1, CGAS, TBK1 CA2 4448/4885CA9 3642/4885TERT 4602/4885

“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.