SCHEMBL13634215

SCHEMBL13634215

C/C=C/c1ccc([N+](=O)[O-])c(C(=O)OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.51
TDP1 Q9NUW8 1/20 0.48
PTGS2 P35354 1/20 0.47
BACE1 P56817 4/20 0.42
PDGFRB P09619 1/20 0.42
FGFR1 P11362 1/20 0.42
PDGFRA P16234 1/20 0.42
FLT1 P17948 1/20 0.42
FGFR3 P22607 1/20 0.42
KDR P35968 1/20 0.42
VCAM1 P19320 1/20 0.41
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41

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
SCHEMBL2769859 0.87 SIRT6 (0.50) SIRT6TDP1PTGS2BACE1PDGFRB
SCHEMBL2769860 0.87 SIRT6 (0.50) SIRT6TDP1PTGS2BACE1PDGFRB
SCHEMBL2772097 0.85 SIRT6 (0.53) SIRT6TDP1PDGFRBFGFR1PDGFRA
SCHEMBL648496 0.84 SIRT6 (0.55) SIRT6TDP1PTGS2BACE1PDGFRB
SCHEMBL27358645 0.82 MEN1 (0.51) SIRT6TDP1PDGFRBFGFR1PDGFRA
SCHEMBL27344177 0.82 MEN1 (0.51) SIRT6TDP1PDGFRBFGFR1PDGFRA
SCHEMBL1202192 0.81 ALDH1A1 (0.41) SIRT6TDP1PTGS2PDGFRBFGFR1
SCHEMBL1202190 0.81 ALDH1A1 (0.41) SIRT6TDP1PTGS2PDGFRBFGFR1
SCHEMBL11389602 0.79 TDP1 (0.59) SIRT6TDP1PTGS2BACE1MAPT
SCHEMBL145815 0.77 SIRT6 (0.57) SIRT6TDP1PDGFRBFGFR1PDGFRA

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
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed