SCHEMBL12748527

SCHEMBL12748527

C#CCn1c(=O)c(C)cn(C(CCO)OCCO)c1=O

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ ADORA2B P29275 2/20 0.31
▸ GLA P06280 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.30

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
SCHEMBL13970127 0.88 KDM4E (0.33) LMNARAB9ASMN1; SMN2ADORA2BGLA
SCHEMBL12748995 0.88 KDM4E (0.33) LMNARAB9ASMN1; SMN2ADORA2BGLA
SCHEMBL12749037 0.81 — —
SCHEMBL13970128 0.75 LMNA (0.31) LMNARAB9ASMN1; SMN2ADORA2BGLA
SCHEMBL1902451 0.69 TYMP (0.42) LMNASMN1; SMN2BLM
SCHEMBL6555940 0.69 TYMP (0.42) LMNASMN1; SMN2BLM
SCHEMBL12748530 0.69 TYMP (0.42) LMNASMN1; SMN2BLM
SCHEMBL14068444 0.68 CHRNE (0.31) —
SCHEMBL13970113 0.67 — —
SCHEMBL13083849 0.64 ADORA2B (0.33) LMNARAB9ASMN1; SMN2ADORA2BGLA

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
US-7928210-B2 Nucleoside based proliferation imaging markers SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-04-19 — — US disclosed
WO-2008109080-A2 NUCLEOSIDE BASED PROLIFERATION IMAGING MARKERS SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2008-09-12 — — WO disclosed
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