SCHEMBL31624560

SCHEMBL31624560

CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OC(C)(C)C)C(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)OC(c1ccccc1)(c1ccccc1)c1ccccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 6/20 0.46
▸ KLK7 P49862 2/20 0.44
▸ KLK5 Q9Y337 2/20 0.44
▸ ITGB3 P05106 1/20 0.41
▸ ITGA2B P08514 1/20 0.41
▸ TPSAB1 Q15661 2/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ TLR2 O60603 1/20 0.41
▸ TLR1 Q15399 1/20 0.41
▸ SIRT1 Q96EB6 4/20 0.40
▸ SIRT3 Q9NTG7 3/20 0.40

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
SCHEMBL31624506 0.94 KLK7 (0.48) SIRT2KLK7KLK5ITGB3ITGA2B
SCHEMBL31624468 0.90 TLR2 (0.40) SIRT2KLK7KLK5ITGB3ITGA2B
SCHEMBL31624488 0.90 TLR2 (0.40) SIRT2KLK7KLK5ITGB3ITGA2B
SCHEMBL31624599 0.88 SIRT2 (0.49) SIRT2KLK7KLK5ITGB3ITGA2B
SCHEMBL31624601 0.88 SIRT2 (0.49) SIRT2KLK7KLK5ITGB3ITGA2B
SCHEMBL31624368 0.87 HDAC1 (0.48) SIRT2KLK7KLK5HDAC1HDAC2
SCHEMBL31624497 0.87 HDAC1 (0.48) SIRT2KLK7KLK5HDAC1HDAC2
SCHEMBL13049087 0.87 TLR2 (0.47) KLK7KLK5TLR2TLR1
SCHEMBL31631382 0.87 SIRT2 (0.52) SIRT2KLK7KLK5SIRT1SIRT3
SCHEMBL31631370 0.87 SIRT2 (0.52) 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 2 patents. 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
WO-2025128624-A2 HYBRID PEPTIDE COMPOUNDS HAVING A SUBSTITUTED TRYPTOPHAN RESIDUE OR A TERMINAL SUBSTITUENT CARMOT THERAPEUTICS, INC. (US) 2025-06-19 — — WO disclosed
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