SCHEMBL29612424

SCHEMBL29612424

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 18/20 0.59
▸ CTSD P07339 2/20 0.54
▸ PGA5 P0DJD9 1/20 0.51

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
SCHEMBL23598225 0.91 ACE (0.57) REN
SCHEMBL7300127 0.91 ACE (0.57) REN
SCHEMBL10522069 0.91 ACE (0.57) REN
SCHEMBL10722951 0.91 REN (0.53) RENCTSDPGA5
Hydrochloric Acid SCHEMBL11413611 0.88 CTSS (0.48) RENCTSDPGA5
Hydrochloric Acid SCHEMBL11413622 0.88 CTSS (0.48) RENCTSDPGA5
SCHEMBL10664132 0.87 REN (0.62) REN
SCHEMBL10664115 0.87 REN (0.62) REN
SCHEMBL10662212 0.85 REN (0.60) RENCTSD
SCHEMBL10659887 0.85 REN (0.60) RENCTSD

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
CN-113045628-B Application of antibacterial peptide or variant thereof in preparation of antibacterial product 山东大学 2022-06-14 — — CN disclosed
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