SCHEMBL21534501

SCHEMBL21534501

CC(C)C(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=S)NCCOCCOCCC(=O)ON1C(=O)CCC1=O)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SIRT5 Q9NXA8 1/20 0.33
▸ FURIN P09958 4/20 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
SCHEMBL18122900 0.94 SIRT5 (0.36) SIRT5FURIN
SCHEMBL19170464 0.92 SIRT5 (0.31) SIRT5FURIN
SCHEMBL21322625 0.90 C3AR1 (0.32) —
SCHEMBL19170915 0.83 FURIN (0.35) FURIN
SCHEMBL19203574 0.83 MEN1 (0.31) —
SCHEMBL24722180 0.79 SIRT2 (0.30) FURIN
SCHEMBL19203552 0.78 SIRT5 (0.40) SIRT5FURIN
SCHEMBL19170914 0.76 FURIN (0.35) SIRT5FURIN
SCHEMBL18122899 0.76 — —
SCHEMBL24860389 0.76 SIRT5 (0.37) SIRT5

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-10463749-B2 Maytansinoid derivatives, conjugates thereof, and methods of use REGENERON PHARMACEUTICALS, INC. (US) 2019-11-05 — — 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-10463749-B2 Maytansinoid derivatives, conjugates thereof, and methods of use HNMT, SLC10A1, SLC10A2 SIRT5 2864/4885FURIN 1025/4885

“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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