SCHEMBL4960232

SCHEMBL4960232

CC(C)(C)OC(=O)NCC(C=O)SC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.45
ATM Q13315 1/20 0.42
IDO1 P14902 1/20 0.41
CTSS P25774 5/20 0.39
CTSK P43235 4/20 0.39
MALT1 Q9UDY8 1/20 0.39
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
KDM4A O75164 1/20 0.38
PPARG P37231 3/20 0.37
PPARA Q07869 3/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
PCSK9 Q8NBP7 1/20 0.36
CKS1B P61024 1/20 0.36
SKP1 P63208 1/20 0.36
SKP2 Q13309 1/20 0.36
NFKB1 P19838 1/20 0.36

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
SCHEMBL16386313 0.82 SYK (0.46) SYKATMIDO1CTSSCTSK
SCHEMBL13203995 0.81 IDO1 (0.53) SYKATMIDO1CTSSCTSK
SCHEMBL14701892 0.77 SYK (0.42) SYKATMIDO1CTSSCTSK
SCHEMBL9027100 0.75 ATM (0.44) ATMCTSSCTSKCTSLCTSB
SCHEMBL7848506 0.75 ATM (0.44) ATMCTSSCTSKCTSLCTSB
SCHEMBL3648358 0.75 CTSK (0.49) SYKATMIDO1CTSSCTSK
SCHEMBL5276867 0.72 CTSK (0.48) ATMCTSSCTSKCTSLCTSB
SCHEMBL906631 0.72 CTSK (0.48) ATMCTSSCTSKCTSLCTSB
SCHEMBL7834971 0.72 CTSK (0.55) SYKATMIDO1CTSSCTSK
SCHEMBL19265866 0.72 IDO1 (0.54) IDO1MALT1CKS1BSKP1SKP2

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
EP-1885875-A2 LUMINOGENIC AND FLUOROGENIC COMPOUNDS AND METHODS TO DETECT MOLECULES OR CONDITIONS PROMEGA CORPORATION (US) 2008-02-13 EP disclosed
WO-2006130551-A2 LUMINOGENIC AND FLUOROGENIC COMPOUNDS AND METHODS TO DETECT MOLECULES OR CONDITIONS PROMEGA CORPORATION (US) 2006-12-07 WO disclosed