SCHEMBL10908555

SCHEMBL10908555

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)c1ccccn1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 11/20 0.59
▸ CTSB P07858 8/20 0.59
▸ REN P00797 2/20 0.51
▸ CTSD P07339 5/20 0.51

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
SCHEMBL10909792 0.89 CTSB (0.55) CTSKCTSBRENCTSD
SCHEMBL10431103 0.88 CTSL (0.61) CTSKCTSB
SCHEMBL10908721 0.87 CTSK (0.57) CTSKCTSBRENCTSD
SCHEMBL10907851 0.82 CTSK (0.57) CTSKCTSBRENCTSD
SCHEMBL11006634 0.81 REN (0.49) CTSKCTSBREN
SCHEMBL31512923 0.80 CTSK (0.69) CTSKCTSB
SCHEMBL31512934 0.80 CTSK (0.69) CTSKCTSB
SCHEMBL31512942 0.80 CTSK (0.69) CTSKCTSB
SCHEMBL8972996 0.79 CTSK (0.70) CTSKCTSB
SCHEMBL8972993 0.79 CTSK (0.70) CTSKCTSB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4613676-A PEPTIDES CIBA-GEIGY CORPORATION (US) 1986-09-23 — — US disclosed
EP-0143746-A2 5-Amino 4-hydroxy-valeryl-substituted derivatives CIBA-GEIGY AG (CH) 1985-06-05 — — EP disclosed
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