SCHEMBL10521833

SCHEMBL10521833

CC(C)C[C@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1nnn[nH]1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 20/20 0.58

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
SCHEMBL8901637 0.88 REN (0.67) REN
SCHEMBL8904372 0.88 REN (0.61) REN
SCHEMBL7360546 0.87 REN (0.72) REN
SCHEMBL7371160 0.87 REN (0.64) REN
SCHEMBL11037229 0.86 REN (0.67) REN
SCHEMBL8894149 0.85 REN (0.62) REN
SCHEMBL8896012 0.85 REN (0.62) REN
SCHEMBL10630607 0.83 REN (0.67) REN
SCHEMBL8894705 0.83 REN (0.58) REN
SCHEMBL11041696 0.82 REN (0.62) 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
US-4829053-A Amino acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-05-09 — — US disclosed
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