SCHEMBL24344796

SCHEMBL24344796

COC(=O)C(CCCNC(=O)c1ccc(N)cc1-c1nnn[nH]1)NC(=O)c1ccc(NCc2ccc3nc(N)nc(N)c3c2Cl)s1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 2/20 0.32
▸ DHFR P00374 2/20 0.31
▸ AKT3 Q9Y243 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
SCHEMBL25725412 1.00 TYMS (0.32) TYMSDHFRAKT3
SCHEMBL25294343 0.93 TYMS (0.36) TYMSDHFR
SCHEMBL24344797 0.93 TYMS (0.36) TYMSDHFR
SCHEMBL24343764 0.89 DHFR (0.35) DHFR
SCHEMBL24344220 0.85 DHFR (0.35) TYMSDHFR
SCHEMBL24343434 0.83 TYMS (0.39) TYMSDHFR
SCHEMBL25298807 0.82 DHFR (0.41) DHFR
SCHEMBL24343805 0.82 DHFR (0.41) DHFR
SCHEMBL24344795 0.80 TDP1 (0.36) DHFR
SCHEMBL30400917 0.79 DHFR (0.35) TYMSDHFR

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-20230144211-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES BYONDIS B.V. (NL) 2023-05-11 — — US disclosed
US-20220119392-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES BYONDIS B.V. (NL) 2022-04-21 — — 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-20230144211-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES DHFR, FOLR1, MTHFD2 TYMS 39/4885DHFR 1/4885AKT3 4505/4885
US-20220119392-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES DHFR, FOLR1, MTHFD2 TYMS 39/4885DHFR 1/4885AKT3 4505/4885

“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.

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