SCHEMBL27291574

SCHEMBL27291574

CCc1ccc(NC(=O)[C@H](CCCCNC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)NC(=O)[C@@H](NC)C(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 1/20 0.42
▸ SIRT2 Q8IXJ6 9/20 0.41
▸ SIRT1 Q96EB6 9/20 0.41
▸ FOLH1 Q04609 1/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ SIRT3 Q9NTG7 3/20 0.38
▸ SIRT5 Q9NXA8 2/20 0.37
▸ CA1 P00915 4/20 0.37
▸ CA2 P00918 4/20 0.37
▸ CA12 O43570 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ CA4 P22748 2/20 0.36

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
SCHEMBL24864619 0.93 FOLH1 (0.40) FURINSIRT2SIRT1FOLH1SIRT3
SCHEMBL24864395 0.85 SIRT2 (0.38) FURINSIRT2SIRT1FOLH1SIRT3
SCHEMBL27292223 0.84 FAP (0.41) FURINSIRT2SIRT1FOLH1SIRT3
SCHEMBL24864633 0.83 QRFPR (0.38) FURINSIRT2SIRT1FOLH1SIRT5
SCHEMBL24864590 0.82 SIRT1 (0.40) SIRT2SIRT1FOLH1SIRT3SIRT5
SCHEMBL24864470 0.80 SIRT1 (0.39) SIRT2SIRT1FOLH1SIRT3SIRT5
SCHEMBL27291528 0.80 FURIN (0.49) FURINSIRT2SIRT1KMT2AATM
SCHEMBL24864606 0.79 SIRT2 (0.47) SIRT2SIRT1SIRT3SIRT5
SCHEMBL27291531 0.78 FURIN (0.49) FURINKMT2AATMCA1CA2
SCHEMBL24864394 0.76 GLP1R (0.40) SIRT2SIRT1FOLH1SIRT5CA1

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-20240207429-A1 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-06-27 — — 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-20240207429-A1 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME PAICS, DHFR, CD44 FURIN 34/4885SIRT2 1070/4885SIRT1 731/4885

“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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