SCHEMBL28587243

SCHEMBL28587243

O=C(Cc1ccc2ccccc2c1)NNc1ccccn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIOK2 Q9BVS4 6/20 0.58
GSK3A P49840 3/20 0.58
MAPK10 P53779 3/20 0.58
MAPK8 P45983 1/20 0.58
HIPK1 Q86Z02 1/20 0.58
SNRK Q9NRH2 1/20 0.58
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
NLRP3 Q96P20 1/20 0.50
SLC6A2 P23975 1/20 0.49
SLC6A3 Q01959 1/20 0.49
POLB P06746 2/20 0.48
PPARG P37231 2/20 0.48
NCOA2 Q15596 2/20 0.48
NCOA1 Q15788 2/20 0.48

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
SCHEMBL28591425 0.83 KMT2A (0.60) KDM4ELMNAGAAHTTSMN1; SMN2
SCHEMBL29404948 0.83 KMT2A (0.54) RIOK2GSK3AMAPK10KDM4EGAA
SCHEMBL28917003 0.83 KMT2A (0.54) RIOK2GSK3AMAPK10KDM4EGAA
SCHEMBL28917422 0.81 KMT2A (0.55) RIOK2KDM4EGAAKMT2AMEN1
SCHEMBL28591047 0.81 KMT2A (0.55) KDM4EGAAKMT2AMEN1SLC6A2
SCHEMBL28585150 0.80 HTT (0.61) RIOK2MAPK10KDM4ELMNAGAA
SCHEMBL28604916 0.77 KMT2A (0.51) RIOK2GAAKMT2AMEN1NLRP3
SCHEMBL24195991 0.74 MEN1 (0.62) RIOK2GSK3AMAPK10MAPK8HIPK1
SCHEMBL5453254 0.73 GAA (0.58) GAASMN1; SMN2KMT2AMEN1SLC6A2
SCHEMBL1520280 0.73 MEN1 (0.65) RIOK2KMT2AMEN1NLRP3NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113135911-B Method for preparing pyridotriazolone compounds by flow chemistry 浙江工业大学 2022-03-18 CN disclosed
CN-113121526-B Method for preparing pyridotriazolone compounds by oxidation rearrangement 浙江工业大学 2022-03-18 CN disclosed
CN-113136594-B Method for electrochemically synthesizing pyridotriazolone compounds 浙江工业大学 2022-03-15 CN disclosed
CN-113136594-A Method for electrochemically synthesizing pyridotriazolone compounds 浙江工业大学 2021-07-20 CN disclosed
CN-113135911-A Method for preparing pyridotriazolone compounds by flow chemistry 浙江工业大学 2021-07-20 CN disclosed
CN-113121526-A Method for preparing pyridotriazolone compounds by oxidation rearrangement 浙江工业大学 2021-07-16 CN disclosed