SCHEMBL14158243

SCHEMBL14158243

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)Cn1c(-c2ccccn2)noc1=O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 7/20 0.49
CTSL P07711 6/20 0.47
CTSB P07858 4/20 0.47
CTSS P25774 2/20 0.47
CAPN1 P07384 1/20 0.47
PSMB1 P20618 1/20 0.46
PSMB5 P28074 1/20 0.46
PSMB2 P49721 1/20 0.46

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
SCHEMBL14158214 0.92 CTSK (0.41) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL14158033 0.90 CTSK (0.54) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL14158091 0.88 CTSK (0.50) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL14158092 0.86 CTSK (0.53) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL14158281 0.86 CTSL (0.52) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL14158035 0.86 CTSK (0.48) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL14158063 0.85 CTSK (0.49) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL14158244 0.85 CTSK (0.49) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL14158064 0.84 CTSK (0.49) CTSKCTSLCTSBCTSSCAPN1
SCHEMBL14158058 0.84 CTSK (0.53) CTSKCTSLCTSBCTSSCAPN1

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-7390804-B2 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-06-24 US disclosed
US-7390804-B2 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-06-24 US disclosed