SCHEMBL19979833

SCHEMBL19979833

Cn1nnnc1NC(=O)c1cccnc1-n1cncn1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.53
CHIA Q9BZP6 1/20 0.38
KDM4E B2RXH2 2/20 0.37
KMT2A Q03164 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 1/20 0.36
MALT1 Q9UDY8 1/20 0.35
GLA P06280 1/20 0.35
HTT P42858 1/20 0.35
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL19979834 0.83 POLB (0.47) POLBKDM4EKMT2ATDP1HTT
SCHEMBL19979837 0.82 POLB (0.52) POLBKMT2AL3MBTL1ALDH1A1
SCHEMBL19979826 0.80 POLB (0.45) POLBKDM4EKMT2ATDP1ALDH1A1
SCHEMBL19979827 0.80 POLB (0.45) POLBKDM4EKMT2ATDP1ALDH1A1
SCHEMBL19980213 0.79 POLB (0.44) POLBKDM4EGLAALDH1A1SMN1; SMN2
SCHEMBL11427377 0.75 POLB (0.60) POLBKDM4EKMT2ATDP1SMN1; SMN2
SCHEMBL19979962 0.74 CYP1A2 (0.46) POLBKDM4EL3MBTL1TDP1
SCHEMBL19979961 0.73 MYC (0.53) POLBKDM4EKMT2AL3MBTL1TDP1
SCHEMBL30597933 0.72 MEN1 (0.56) KDM4EKMT2AL3MBTL1ALDH1A1
SCHEMBL885409 0.72 PARP1 (0.44) KDM4EHTTALDH1A1SMN1; SMN2

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
WO-2018050677-A1 HERBICIDAL PYRIDINES SYNGENTA PARTICIPATIONS AG (CH) 2018-03-22 WO disclosed