SCHEMBL31624601

SCHEMBL31624601

CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)CC[C@H](N)C(=O)OC(C)(C)C)C(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)OC(c1ccccc1)(c1ccccc1)c1ccccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 11/20 0.49
▸ KLK7 P49862 2/20 0.46
▸ KLK5 Q9Y337 2/20 0.46
▸ SIRT1 Q96EB6 9/20 0.45
▸ SIRT3 Q9NTG7 8/20 0.45
▸ ITGB3 P05106 1/20 0.43
▸ ITGA2B P08514 1/20 0.43
▸ TPSAB1 Q15661 1/20 0.43
▸ MAPT P10636 1/20 0.42

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
SCHEMBL31624599 1.00 SIRT2 (0.49) SIRT2KLK7KLK5SIRT1SIRT3
SCHEMBL31624336 0.89 SIRT2 (0.41) SIRT2KLK7KLK5SIRT1SIRT3
SCHEMBL31631382 0.89 SIRT2 (0.52) SIRT2KLK7KLK5SIRT1SIRT3
SCHEMBL31631370 0.89 SIRT2 (0.52) SIRT2KLK7KLK5SIRT1SIRT3
SCHEMBL31624411 0.89 SIRT2 (0.54) SIRT2KLK7KLK5SIRT1SIRT3
SCHEMBL31631364 0.89 SIRT2 (0.54) SIRT2KLK7KLK5SIRT1SIRT3
SCHEMBL31624560 0.88 SIRT2 (0.46) SIRT2KLK7KLK5SIRT1SIRT3
SCHEMBL31624430 0.87 SIRT2 (0.49) SIRT2KLK7KLK5SIRT1SIRT3
SCHEMBL31624487 0.87 SIRT2 (0.49) SIRT2KLK7KLK5SIRT1SIRT3
SCHEMBL31624506 0.82 KLK7 (0.48) SIRT2KLK7KLK5SIRT1SIRT3

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-2025128626-A1 HYBRID PEPTIDE COMPOUNDS HAVING A MODIFIED LYSINE RESIDUE CARMOT THERAPEUTICS, INC. (US) 2025-06-19 — — WO disclosed
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