Triaziquone

Triaziquone

SCHEMBL7716307

O=C1C=C(N2CC2)C(=O)C(N2CC2)=C1N1CC1.Oc1cccc2ncccc12

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.44
TSHR P16473 2/20 0.44
HIF1A Q16665 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPK1 P28482 1/20 0.44
NFKB1 P19838 1/20 0.40
THPO P40225 1/20 0.40
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
BLM P54132 1/20 0.39
CHRM1 P11229 3/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
COMT P21964 1/20 0.36
HTR1A P08908 4/20 0.35
DRD2 P14416 4/20 0.35
HTR2A P28223 4/20 0.35
HTR7 P34969 4/20 0.35
HTR6 P50406 4/20 0.35

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
Triaziquone SCHEMBL3240330 0.84 TSHR (0.42) CYP3A4TSHRHIF1ACYP1A2CYP2D6
Triaziquone SCHEMBL60990 0.81 KDM4E (0.54) CYP3A4TSHRHIF1ACYP1A2CYP2D6
Triaziquone SCHEMBL2330689 0.81 KDM4E (0.52) CYP3A4TSHRHIF1ACYP1A2CYP2D6
Triaziquone SCHEMBL4773780 0.81 KDM4E (0.52) CYP3A4TSHRHIF1ACYP1A2CYP2D6
Triaziquone SCHEMBL1991925 0.81 KDM4E (0.52) CYP3A4TSHRHIF1ACYP1A2CYP2D6
Triaziquone SCHEMBL16818404 0.81 KDM4E (0.52) CYP3A4TSHRHIF1ACYP1A2CYP2D6
Triaziquone SCHEMBL312861 0.81 KDM4E (0.52) CYP3A4TSHRHIF1ACYP1A2CYP2D6
Triaziquone SCHEMBL4564293 0.79 CYP1A2 (0.38) CYP3A4TSHRHIF1ACYP1A2CYP2D6
Triaziquone SCHEMBL729528 0.79 HTT (0.58) CYP3A4TSHRHIF1ACYP1A2CYP2D6
Triaziquone SCHEMBL6237000 0.79 KDM4E (0.58) CYP3A4TSHRHIF1ACYP1A2CYP2D6

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
EP-0950254-A4 AN ORGANIC LIGHT EMITTING DEVICE CONTAINING A PROTECTION LAYER UNIV PRINCETON (US) 2002-11-27 EP disclosed
EP-0950254-A1 AN ORGANIC LIGHT EMITTING DEVICE CONTAINING A PROTECTION LAYER THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1999-10-20 EP disclosed
WO-1998028767-A9 AN ORGANIC LIGHT EMITTING DEVICE CONTAINING A PROTECTION LAYER 1998-11-05 WO disclosed
WO-1998028767-A1 AN ORGANIC LIGHT EMITTING DEVICE CONTAINING A PROTECTION LAYER THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1998-07-02 WO disclosed