SCHEMBL10908074

SCHEMBL10908074

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(C)C)C(=O)NC(=O)CN1CCOCC1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 11/20 0.56
▸ CTSB P07858 7/20 0.56
▸ CTSL P07711 1/20 0.51
▸ REN P00797 1/20 0.49
▸ CTSD P07339 4/20 0.48
▸ PSMB5 P28074 1/20 0.48

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
SCHEMBL10908290 0.89 CTSK (0.52) CTSKCTSBCTSLRENCTSD
SCHEMBL10556667 0.88 CTSB (0.57) CTSKCTSBCTSL
SCHEMBL10905624 0.87 CTSK (0.58) CTSKCTSBCTSLPSMB5
SCHEMBL10908721 0.79 CTSK (0.57) CTSKCTSBRENCTSD
SCHEMBL8895231 0.78 CTSS (0.55) CTSKCTSBCTSL
SCHEMBL8893671 0.78 CTSS (0.55) CTSKCTSBCTSL
SCHEMBL10908555 0.78 CTSK (0.59) CTSKCTSBRENCTSD
SCHEMBL31512934 0.77 CTSK (0.69) CTSKCTSBCTSL
SCHEMBL31512942 0.77 CTSK (0.69) CTSKCTSBCTSL
SCHEMBL31512923 0.77 CTSK (0.69) CTSKCTSBCTSL

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-4613676-A PEPTIDES CIBA-GEIGY CORPORATION (US) 1986-09-23 — — US disclosed
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