SCHEMBL11013919

SCHEMBL11013919

CC[C@H](C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(N)=O

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 19/20 0.66
▸ CTSB P07858 1/20 0.49
▸ CTSK P43235 1/20 0.49

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
SCHEMBL11010625 1.00 REN (0.66) RENCTSBCTSK
SCHEMBL9716847 0.91 REN (0.66) RENCTSBCTSK
SCHEMBL10448117 0.89 REN (0.60) RENCTSBCTSK
SCHEMBL11013722 0.86 REN (0.58) REN
SCHEMBL11011996 0.85 REN (0.57) RENCTSBCTSK
SCHEMBL10980049 0.82 REN (0.60) RENCTSB
SCHEMBL10980046 0.82 REN (0.60) RENCTSB
SCHEMBL10981774 0.82 REN (0.60) RENCTSB
SCHEMBL9716892 0.82 REN (0.65) REN
SCHEMBL10724802 0.81 REN (0.61) REN

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
EP-0143746-A2 5-Amino 4-hydroxy-valeryl-substituted derivatives CIBA-GEIGY AG (CH) 1985-06-05 — — EP claimed
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