SCHEMBL10656077

SCHEMBL10656077

CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)OCc1ccccc1)[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)N[C@@H](CCC(=O)ONC(=O)OCc1ccccc1)CC(C)C

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 17/20 0.50
▸ CTSD P07339 4/20 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
SCHEMBL11018761 0.83 REN (0.67) RENCTSD
SCHEMBL11023662 0.81 REN (0.65) RENCTSD
SCHEMBL9716892 0.80 REN (0.65) REN
SCHEMBL9716847 0.80 REN (0.66) RENCTSD
SCHEMBL10656545 0.80 CTSB (0.48) RENCTSD
SCHEMBL10630585 0.79 REN (0.63) RENCTSD
SCHEMBL10526700 0.77 REN (0.54) REN
SCHEMBL10526691 0.77 REN (0.54) REN
SCHEMBL11014099 0.76 REN (0.58) RENCTSD
SCHEMBL29612424 0.76 REN (0.59) 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
US-4746649-A Diamino acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1988-05-24 — — US disclosed
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