SCHEMBL10448496

SCHEMBL10448496

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

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 16/20 0.47
▸ CTSD P07339 6/20 0.45

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
SCHEMBL10448497 0.88 REN (0.60) REN
SCHEMBL10448117 0.81 REN (0.60) REN
SCHEMBL10447999 0.78 REN (0.42) RENCTSD
SCHEMBL10447998 0.78 REN (0.42) RENCTSD
SCHEMBL11013919 0.77 REN (0.66) REN
SCHEMBL11010625 0.77 REN (0.66) REN
SCHEMBL11013722 0.73 REN (0.58) REN
SCHEMBL10433962 0.71 REN (0.53) RENCTSD
SCHEMBL7370152 0.71 REN (0.56) RENCTSD
SCHEMBL7351443 0.70 REN (0.64) 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
EP-0386611-A2 Amino acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1990-09-12 — — EP disclosed
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