SCHEMBL27896288

SCHEMBL27896288

[N-]=[N+]=NCc1cccc2cc3cccc(CN=[N+]=[N-])c3nc12

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TERT O14746 10/20 0.40
KAT2B Q92831 2/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MCL1 Q07820 1/20 0.32
PDE4A P27815 2/20 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
SCHEMBL16896765 0.77 KAT2B (0.37) KAT2BKDM4EALDH1A1MCL1
SCHEMBL13853065 0.74 DRD4 (0.36) KAT2B
SCHEMBL13754457 0.74 CYP2C19 (0.47) KAT2BALDH1A1
SCHEMBL28312340 0.74 KAT2B (0.47) KAT2BKDM4EALDH1A1MCL1
SCHEMBL13656742 0.72 KAT2B (0.40) KAT2BKDM4EALDH1A1MCL1
SCHEMBL13762652 0.72 KAT2B (0.40) KAT2BKDM4EALDH1A1MCL1
SCHEMBL14047545 0.72 DRD4 (0.52) KDM4EALDH1A1MCL1
SCHEMBL14531021 0.71 ALDH1A1 (0.47) KAT2BKDM4EALDH1A1
SCHEMBL16305499 0.71 KAT2B (0.39) KAT2BKDM4EALDH1A1MCL1
SCHEMBL13456730 0.70 KAT2B (0.35) KAT2BKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103012375-B Pyridyl triazole methyl substituted acridine derivative, preparation method and application thereof UNIV GUIZHOU 2014-04-09 CN claimed
CN-103012375-A Pyridyl triazole methyl substituted acridine derivative, preparation method and application thereof UNIV GUIZHOU 2013-04-03 CN claimed
CN-103012375-B Pyridyl triazole methyl substituted acridine derivative, preparation method and application thereof UNIV GUIZHOU 2014-04-09 CN disclosed
CN-103012375-A Pyridyl triazole methyl substituted acridine derivative, preparation method and application thereof UNIV GUIZHOU 2013-04-03 CN disclosed