SCHEMBL28044545

SCHEMBL28044545

CN(CC[As](C)C)c1cc[c]c([N+](=O)[O-])c1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
HTR7 P34969 1/20 0.35
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL589760 0.84 MAPT (0.38) MAPTHTR7KDM4EALDH1A1
SCHEMBL28044527 0.84 MAPT (0.32) MAPTALDH1A1
SCHEMBL589567 0.82 MAPT (0.42) MAPTHTR7KDM4EALDH1A1
SCHEMBL590762 0.80 MAPT (0.35) MAPTHTR7KDM4EALDH1A1
SCHEMBL3211653 0.77 MAPT (0.47) MAPTALDH1A1
SCHEMBL592328 0.76 HTR7 (0.49) HTR7ALDH1A1
SCHEMBL591011 0.75 HTR7 (0.50) MAPTHTR7KDM4EALDH1A1
SCHEMBL590610 0.72 MAPT (0.33) MAPTALDH1A1
SCHEMBL28044536 0.70 HTR7 (0.33) HTR7
SCHEMBL28044441 0.69 HCAR3 (0.41) MAPTKDM4EALDH1A1

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-101594862-B Substituted indazole derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-11-25 CN disclosed