SCHEMBL28306205

SCHEMBL28306205

CS(=O)(=O)c1cc(C2CC2)c([N+](=O)[O-])c(N)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.35
HRH4 Q9H3N8 4/20 0.34
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CCNA1 P78396 1/20 0.33
MAPT P10636 4/20 0.33
ATM Q13315 3/20 0.33
XBP1 P17861 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 4/20 0.32
LMNA P02545 4/20 0.32
ALDH1A1 P00352 3/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
MAPK1 P28482 1/20 0.32
BLM P54132 2/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
HTT P42858 3/20 0.32

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
SCHEMBL28307339 0.77 MAPT (0.38) KMT2AMAPTATMXBP1MEN1
SCHEMBL26698357 0.77 KMT2A (0.38) KMT2ACCNA2CDK2CCNA1MAPT
SCHEMBL28307341 0.75 HTT (0.45) HRH4MAPTATML3MBTL1LMNA
SCHEMBL28307340 0.74 MAPT (0.39) KMT2AHRH4MAPTATMMEN1
SCHEMBL28307335 0.71 HTT (0.38) HRH4MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL28306200 0.69 GLP1R (0.33) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL28307334 0.69 TLR8 (0.37) KMT2AMAPTL3MBTL1MEN1LMNA
SCHEMBL22696605 0.68 HTT (0.44) KMT2ACCNA2CDK2CCNA1MAPT
SCHEMBL29974026 0.64 CCNA2 (0.48) KMT2ACCNA2CDK2CCNA1ATM
SCHEMBL28877937 0.64 CCNA2 (0.48) KMT2ACCNA2CDK2CCNA1ATM

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
CN-109970633-A Pyridine sulfone and its derivative, preparation method and application 湖南化工研究院有限公司 2019-07-05 CN disclosed