SCHEMBL7112253

SCHEMBL7112253

O=[N+]([O-])c1cc[c]c(O)c1N=Nc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 2/20 0.40
CDK2 P24941 1/20 0.39
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 3/20 0.38
HSP90AA1 P07900 2/20 0.38
MAPK1 P28482 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
RECQL P46063 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
IDO1 P14902 1/20 0.37
PTPN11 Q06124 1/20 0.36

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
SCHEMBL5954066 0.77 GPR35 (0.50) MEN1KMT2ANPC1RAB9ACDK2
SCHEMBL592656 0.73 MEN1 (0.51) MEN1KMT2ANPC1RAB9ACDK2
SCHEMBL4369183 0.72 ALDH1A1 (0.39) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL9391661 0.72 GPR35 (0.47) MEN1KMT2ANPC1RAB9ACDK2
SCHEMBL14690613 0.71 SMN1; SMN2 (0.45) MEN1KMT2ANPC1RAB9ACDK2
SCHEMBL7538896 0.71 ALDH1A1 (0.40) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL8689441 0.71 THRB (0.49) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL9336847 0.70 GPR35 (0.54) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL7086751 0.70 PTPN11 (0.50) MEN1KMT2ANPC1RAB9ACDK2
SCHEMBL28542319 0.70 THRB (0.48) MEN1KMT2ANPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1351944-A1 METHOD FOR PREPARING 2-(2-HYDROXYPHENYL)-2H-BENZOTRIAZOLE LG Chem Ltd. (KR) 2003-10-15 EP disclosed
WO-2002055508-A1 METHOD FOR PREPARING 2-(2-HYDROXYPHENYL)-2H-BENZOTRIAZOLE LG CHEM, LTD. (KR) 2002-07-18 WO disclosed