SCHEMBL9853166

SCHEMBL9853166

COc1ncnc(C)n1.Cc1nc(C)nc(NN)n1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
EGFR P00533 1/20 0.35
KDR P35968 1/20 0.35
AGTR1 P30556 1/20 0.30
MAPT P10636 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
SCHEMBL6748007 0.82
SCHEMBL9847127 0.80 GAA (0.53) GAAMEN1KMT2AL3MBTL1EGFR
SCHEMBL9847094 0.73 GAA (0.50) GAAMEN1KMT2AL3MBTL1EGFR
SCHEMBL2654847 0.69 MEN1 (0.40) MEN1KMT2AEGFRMAPT
SCHEMBL23516614 0.69 GAA (0.55) GAAMEN1KMT2AL3MBTL1EGFR
SCHEMBL10618087 0.68 MEN1 (0.47) GAAMEN1KMT2AMAPT
SCHEMBL6342292 0.67 GAA (0.44) GAAMEN1KMT2AL3MBTL1EGFR
SCHEMBL5026410 0.67 GAA (0.48) GAAMEN1KMT2AL3MBTL1EGFR
SCHEMBL8844371 0.66 GAA (0.47) GAAMEN1KMT2AL3MBTL1MAPT
SCHEMBL467436 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0419831-A2 Substituted sulfonylaminoazoles BAYER AG (DE) 1991-04-03 EP disclosed