SCHEMBL25833845

SCHEMBL25833845

CN[C@H](C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(=O)N(C)[C@H](C(=O)N[C@H](C(=O)N(C)C)C(C)C)C(C)C)cc1)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAP Q12884 1/20 0.40
FURIN P09958 3/20 0.37
SIRT2 Q8IXJ6 8/20 0.36
SIRT1 Q96EB6 7/20 0.36
SIRT3 Q9NTG7 3/20 0.36
SIRT5 Q9NXA8 3/20 0.35
HTT P42858 1/20 0.35
CTSB P07858 1/20 0.33
CTSK P43235 1/20 0.33
PTGER4 P35408 1/20 0.33

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
SCHEMBL25564557 0.95 FAP (0.38) FAPFURINSIRT2SIRT1SIRT3
SCHEMBL21082516 0.92 FAP (0.39) FAPFURINSIRT2SIRT1SIRT3
SCHEMBL24095912 0.92 FAP (0.40) FAPFURINSIRT2SIRT1SIRT3
SCHEMBL26560488 0.90 FAP (0.39) FAPSIRT2SIRT1SIRT3SIRT5
SCHEMBL22871647 0.88 FAP (0.38) FAPFURINSIRT2SIRT1SIRT3
SCHEMBL19869029 0.87 FAP (0.40) FAPFURINSIRT2SIRT1SIRT3
SCHEMBL25833839 0.86 CYP3A4 (0.41) FAPFURINSIRT2SIRT1SIRT3
SCHEMBL24668375 0.86 FAP (0.45) FAPFURINSIRT2SIRT1SIRT3
SCHEMBL24584968 0.85 FAP (0.39) FAPFURINSIRT2SIRT1SIRT3
SCHEMBL20798881 0.85 FAP (0.38) FAPFURINSIRT2SIRT1SIRT3

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-11701427-B2 Diels-alder conjugation methods REGENERON PHARMACEUTICALS, INC. (US) 2023-07-18 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-11701427-B2 Diels-alder conjugation methods GLUL, TGM2, GLS FAP 577/4885FURIN 826/4885SIRT2 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.