SCHEMBL27213475

SCHEMBL27213475

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCCCC[C@H](NC(=O)O)C(=O)NCCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 1/20 0.36
▸ SIRT1 Q96EB6 1/20 0.36
▸ FURIN P09958 6/20 0.36
▸ SIRT5 Q9NXA8 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ GLP1R P43220 8/20 0.35
▸ NPY1R P25929 1/20 0.34
▸ NPY4R P50391 1/20 0.34

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
SCHEMBL19681567 0.91 FURIN (0.39) FURINSIRT5NPY1RNPY4R
SCHEMBL27148471 0.91 FURIN (0.34) SIRT2SIRT1FURINSIRT5ROCK2
SCHEMBL27152493 0.88 ROCK2 (0.43) FURINROCK2
SCHEMBL27152491 0.88 ROCK2 (0.43) FURINROCK2
SCHEMBL30874648 0.86 TLR2 (0.41) SIRT2SIRT1SIRT5
SCHEMBL15699736 0.86 FURIN (0.40) SIRT1FURINSIRT5NPY1RNPY4R
SCHEMBL25787504 0.86 FURIN (0.40) SIRT1FURINSIRT5NPY1RNPY4R
SCHEMBL22138596 0.85 FURIN (0.39) FURINROCK2NPY1RNPY4R
SCHEMBL20705515 0.85 FURIN (0.39) FURINROCK2NPY1RNPY4R
SCHEMBL30297062 0.85 HTT (0.41) SIRT2SIRT1FURINNPY1RNPY4R

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-20240148895-A1 ANTIBODY-DRUG CONJUGATE EISAI R&D MANAGEMENT CO., LTD. (JP) 2024-05-09 — — 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-20240148895-A1 ANTIBODY-DRUG CONJUGATE ANTXR2, FCGR1A, HAX1 SIRT2 3240/4885SIRT1 4007/4885FURIN 901/4885

“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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