SCHEMBL3025206

SCHEMBL3025206

Cc1cn(O[SiH3])c(=O)[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.46
▸ HPGD P15428 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ TYMP P19971 3/20 0.40
▸ TK1 P04183 1/20 0.39
▸ LMNA P02545 1/20 0.36
▸ ALB P02768 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ ADRA1A P35348 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ TK2 O00142 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
SCHEMBL6703360 0.78 MAPK1 (0.45) MAPK1HPGDALDH1A1NPSR1TYMP
SCHEMBL19995056 0.77 MAPK1 (0.44) MAPK1HPGDALDH1A1NPSR1TYMP
SCHEMBL2635616 0.76 MAPK1 (0.42) MAPK1HPGDALDH1A1NPSR1TYMP
SCHEMBL4342113 0.74 TYMP (0.49) MAPK1HPGDTYMPTK1
SCHEMBL8910349 0.74 MAPK1 (0.41) MAPK1HPGDTYMPTK1
SCHEMBL6911384 0.73 TYMP (0.44) MAPK1HPGDTYMPTK1
SCHEMBL13724687 0.72 MAPK1 (0.43) MAPK1HPGDTYMPTK1LMNA
SCHEMBL21886851 0.72 MAPK1 (0.40) MAPK1HPGDALDH1A1NPSR1TYMP
SCHEMBL11257611 0.72 TK1 (0.49) MAPK1HPGDTYMPTK1TK2
SCHEMBL7832846 0.72 MAPK1 (0.43) MAPK1HPGDALDH1A1NPSR1TYMP

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-20100196273-A1 NOVEL AGENT FOR IN VIVO PET IMAGING OF TUMOR PROLIFERATION BOARD OF REGENTS, UNIVERSITY OF TEXAS SYSTEM 2010-08-05 — — US disclosed
WO-2008100848-A2 NOVEL AGENT FOR IN VIVO PET IMAGING OF TUMOR PROLIFERATION BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-08-21 — — WO disclosed
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