SCHEMBL7448752

SCHEMBL7448752

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nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSK P43235 11/20 0.33
SMYD3 Q9H7B4 2/20 0.31

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
SCHEMBL7456061 1.00 CTSK (0.33) CTSKSMYD3
SCHEMBL7453888 0.80
SCHEMBL7447479 0.80
SCHEMBL7451271 0.78 CTSK (0.38) CTSK
SCHEMBL7455803 0.77 CTSK (0.37) CTSK
SCHEMBL7521949 0.75 CTSK (0.44) CTSK
SCHEMBL7448746 0.74 CTSK (0.32) CTSK
SCHEMBL7453472 0.74 CTSK (0.32) CTSK
SCHEMBL7451825 0.62 PSEN1 (0.36)
SCHEMBL3392036 0.60 ALDH1A1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1153022-A4 PROTHEASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2002-03-27 EP disclosed
EP-1153022-A1 PROTHEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-11-14 EP disclosed
WO-2000049011-A1 PROTHEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2000-08-24 WO disclosed