SCHEMBL11246375

SCHEMBL11246375

CC(C)SNc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 10/20 0.61
MEN1 O00255 2/20 0.52
MAPT P10636 2/20 0.52
KMT2A Q03164 2/20 0.52
GAA P10253 2/20 0.52
MAPK1 P28482 1/20 0.52
KDM4E B2RXH2 1/20 0.52
CTSK P43235 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
LMNA P02545 1/20 0.49
ALDH1A1 P00352 1/20 0.47
NFKB1 P19838 1/20 0.47

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
SCHEMBL633400 0.78 MEN1 (0.77) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL6898556 0.76 TDP1 (0.48) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL23786202 0.76 KCNH3 (0.67) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL30568835 0.76 KCNH3 (1.00) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL11257385 0.74 MEN1 (0.55) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL18123046 0.74 MEN1 (0.71) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL3294680 0.73 KCNH3 (0.73) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL11936604 0.72 MAPT (0.63) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL14869417 0.72 GAA (0.81) KCNH3MEN1MAPTKMT2AGAA
SCHEMBL12634410 0.72 GAA (0.81) KCNH3MEN1MAPTKMT2AGAA

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-4339577-A CROSSLINKING INHIBITORS FOR RUBBERS MONSANTO COMPANY (US) 1982-07-13 US disclosed
US-4301260-A Vulcanizable rubber compositions scorch inhibited by 2-(thioamino)-4,6-diamino-1,3,5-triazines MONSANTO COMPANY (US) 1981-11-17 US disclosed