Triaziquone

Triaziquone

SCHEMBL6204619

NCCNCc1ccccn1.O=C1C=C(N2CC2)C(=O)C(N2CC2)=C1N1CC1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.45
TSHR P16473 2/20 0.43
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALOX15 P16050 1/20 0.43
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPK1 P28482 1/20 0.38
HIF1A Q16665 1/20 0.38
SCN8A Q9UQD0 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.36
KDM4E B2RXH2 4/20 0.36
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HRH1 P35367 2/20 0.35
POLB P06746 1/20 0.35
DNMT1 P26358 1/20 0.35
PRMT1 Q99873 1/20 0.34

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
SCHEMBL160154 0.76 CHRM2 (0.73) CHRM2TSHRALDH1A1L3MBTL1ALOX15
Triaziquone SCHEMBL7753135 0.75 CYP1A2 (0.48) TSHRALDH1A1L3MBTL1ALOX15CYP1A2
Ammonia Solution, Strong SCHEMBL28870671 0.75 CHRM2 (0.71) CHRM2TSHRALDH1A1L3MBTL1ALOX15
SCHEMBL28920982 0.75 CHRM2 (0.71) CHRM2TSHRALDH1A1L3MBTL1ALOX15
Triaziquone SCHEMBL17045821 0.74 CYP1A2 (0.47) TSHRALDH1A1L3MBTL1ALOX15CYP1A2
Triaziquone SCHEMBL4261725 0.74 CYP1A2 (0.47) TSHRALDH1A1L3MBTL1ALOX15CYP1A2
Triaziquone SCHEMBL1927726 0.74 CYP1A2 (0.47) TSHRALDH1A1L3MBTL1ALOX15CYP1A2
Triaziquone SCHEMBL11173238 0.74 CYP1A2 (0.47) TSHRALDH1A1L3MBTL1ALOX15CYP1A2
SCHEMBL28455774 0.73 CHRM2 (0.74) CHRM2TSHRALDH1A1L3MBTL1ALOX15
SCHEMBL3319194 0.73 CHRM2 (0.74) CHRM2TSHRALDH1A1L3MBTL1ALOX15

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-1506277-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2005-02-16 EP disclosed
WO-2003097780-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2003-11-27 WO disclosed
EP-1341893-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2003-09-10 EP disclosed
WO-2002048307-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2002-06-20 WO disclosed