SCHEMBL7335239

SCHEMBL7335239

CCCCCCCCc1nc(CC(C=O)NC(=O)OC(C)(C)C)c[nH]1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSK P43235 20/20 0.41
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37

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
SCHEMBL7335233 0.84 CTSK (0.34) CTSK
SCHEMBL8992436 0.74 NPSR1 (0.43) CTSK
SCHEMBL7272929 0.73 CPB2 (0.50) CTSK
SCHEMBL2425416 0.73 CTSK (0.49) CTSKCTSLCTSB
SCHEMBL14423614 0.73 CTSK (0.49) CTSKCTSLCTSB
SCHEMBL5477122 0.73 CTSK (0.56) CTSKCTSLCTSB
Acetic Acid SCHEMBL28946334 0.72 KCNH2 (0.47)
SCHEMBL31471965 0.71 CTSK (0.71) CTSK
SCHEMBL7271497 0.70 CTSK (0.53) CTSKCTSLCTSB
SCHEMBL4445935 0.70 KCNH2 (0.50)

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-0486011-A2 Pharmaceutical composition against Pneumocystis carinii FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-05-20 EP disclosed