SCHEMBL24864470

SCHEMBL24864470

C=N[C@H](C(=O)N[C@@H](CCCCNC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)C(=O)Nc1ccc(CO)cc1)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SIRT1 Q96EB6 7/20 0.39
▸ SIRT2 Q8IXJ6 7/20 0.39
▸ FOLH1 Q04609 1/20 0.38
▸ SIRT5 Q9NXA8 3/20 0.37
▸ CA1 P00915 7/20 0.36
▸ CA2 P00918 7/20 0.36
▸ CA12 O43570 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ CA4 P22748 3/20 0.36
▸ SIRT3 Q9NTG7 3/20 0.35

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
SCHEMBL24864590 0.88 SIRT1 (0.40) SIRT1SIRT2FOLH1SIRT5CA1
SCHEMBL24864619 0.87 FOLH1 (0.40) SIRT1SIRT2FOLH1SIRT5CA1
SCHEMBL24864395 0.83 SIRT2 (0.38) SIRT1SIRT2FOLH1SIRT5CA1
SCHEMBL24864633 0.82 QRFPR (0.38) SIRT1SIRT2FOLH1SIRT5CA1
SCHEMBL24864394 0.82 GLP1R (0.40) SIRT1SIRT2FOLH1SIRT5CA1
SCHEMBL27291574 0.80 FURIN (0.42) SIRT1SIRT2FOLH1SIRT5CA1
SCHEMBL24864606 0.78 SIRT2 (0.47) SIRT1SIRT2SIRT5SIRT3
SCHEMBL24864438 0.76 FOLH1 (0.39) SIRT1SIRT2FOLH1SIRT5SIRT3
SCHEMBL27292223 0.72 FAP (0.41) SIRT1SIRT2FOLH1SIRT5SIRT3
SCHEMBL27291562 0.71 FURIN (0.37) SIRT1SIRT2FOLH1SIRT5CA1

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
WO-2023280227-A2 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME PROFOUNDBIO US CO. (US) 2023-01-12 — — WO disclosed
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