SCHEMBL63309

SCHEMBL63309

COC(Nc1nc(NCO)nc(NCO)n1)(OC)OC

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.34
MAPT P10636 1/20 0.34
LMNA P02545 4/20 0.34
ALDH1A1 P00352 3/20 0.34
KMT2A Q03164 2/20 0.33
GAA P10253 3/20 0.33
MEN1 O00255 1/20 0.32
MCL1 Q07820 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CYP1A2 P05177 3/20 0.32
CYP2C19 P33261 3/20 0.32
HTT P42858 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 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
Hexamethylolmelamine SCHEMBL762278 0.89 ALDH1A1 (0.33) SMN1; SMN2MAPTLMNAALDH1A1KMT2A
Hexamethylolmelamine SCHEMBL8590629 0.82 KMT2A (0.39) LMNAALDH1A1KMT2AGAAMEN1
Hexamethylolmelamine SCHEMBL62548 0.76 KMT2A (0.39) LMNAALDH1A1KMT2AGAAMEN1
SCHEMBL762277 0.76 ALDH1A1 (0.30) ALDH1A1
Hexamethylolmelamine SCHEMBL4055297 0.76 MEN1 (0.39) LMNAALDH1A1KMT2AGAAMEN1
SCHEMBL5318011 0.74 KMT2A (0.34) LMNAALDH1A1KMT2AGAAMEN1
SCHEMBL12155339 0.74 MEN1 (0.38) LMNAALDH1A1KMT2AGAAMEN1
Hexamethylolmelamine SCHEMBL11651779 0.74 KMT2A (0.39) LMNAALDH1A1KMT2AGAAMEN1
SCHEMBL62432 0.71 GAA (0.34) ALDH1A1GAAL3MBTL1CYP1A2CYP2C19
SCHEMBL19670086 0.70 CA1 (0.39) LMNAALDH1A1KMT2AGAAMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129090-B2 Process for on-press developable lithographic printing plate involving preheat TENG GARY GANGHUI (US) 2012-03-06 US disclosed
US-7966934-B2 Process for on-press developing overcoat-free lithographic printing plate TENG GARY GANGHUI 2011-06-28 US disclosed
US-20090061364-A1 Process for on-press developable lithographic printing plate involving preheat TENG GARY GANGHUI 2009-03-05 US disclosed
US-20090025591-A1 Process for on-press developing overcoat-free lithographic printing plate TENG GARY GANGHUI 2009-01-29 US disclosed