SCHEMBL19190688

SCHEMBL19190688

CC(C)CC(NC(=O)OCc1ccccc1)C(=O)NC(C)CCC(=O)O

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 11/20 0.69
▸ CTSL P07711 6/20 0.65
▸ CTSS P25774 3/20 0.65
▸ CTSB P07858 3/20 0.65
▸ CAPN1 P07384 1/20 0.60
▸ CAPN2 P17655 1/20 0.60

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
SCHEMBL8059745 0.94 CTSK (0.67) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL5827200 0.90 CTSK (0.67) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL31094975 0.90 CTSK (0.67) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL14514052 0.88 CTSK (0.75) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL18848786 0.88 CTSK (0.75) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL16770328 0.88 CTSK (0.65) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL14433713 0.87 CTSK (0.64) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL13589982 0.87 CTSK (0.64) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL7921828 0.87 CTSK (0.73) CTSKCTSLCTSSCTSBCAPN1
SCHEMBL6383945 0.86 CTSK (0.66) CTSKCTSLCTSSCTSBCAPN1

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
EP-2545041-B1 BIOLUMINESCENT ASSAYS USING CYANOBENZOTHIAZOLE COMPOUNDS PROMEGA CORP (US) 2017-08-02 — — EP disclosed
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