SCHEMBL14374880

SCHEMBL14374880

CCNC(CCSC)C(=O)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.38
▸ CTSS P25774 1/20 0.38
▸ CTSK P43235 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ RNPEP Q9H4A4 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ USP2 O75604 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ ANPEP P15144 1/20 0.34
▸ PPID Q08752 1/20 0.34

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
SCHEMBL10079875 0.85 — —
SCHEMBL12301654 0.81 FPR2 (0.35) CTSSCTSKKDM4EALDH1A1NPSR1
SCHEMBL14347466 0.80 CTSS (0.38) LMNACTSSCTSKMAPK1RNPEP
SCHEMBL23065777 0.80 CTSS (0.38) LMNACTSSCTSKMAPK1RNPEP
SCHEMBL26854829 0.80 FOLH1 (0.34) LMNACTSSCTSKRNPEPL3MBTL1
SCHEMBL14404929 0.79 LMNA (0.51) LMNAMAPK1RNPEPGAAL3MBTL1
SCHEMBL3869335 0.79 LMNA (0.51) LMNAMAPK1RNPEPGAAL3MBTL1
SCHEMBL23585048 0.79 LMNA (0.41) LMNAMAPK1RNPEPGAAL3MBTL1
SCHEMBL3869337 0.79 LMNA (0.51) LMNAMAPK1RNPEPGAAL3MBTL1
SCHEMBL20078588 0.79 CTSS (0.40) LMNACTSSCTSKMAPK1RNPEP

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
US-7312211-B2 Pryanone compounds useful as reversible inhibitors of cysteine proteases BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2007-12-25 — — US disclosed
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