SCHEMBL4723909

SCHEMBL4723909

COc1ccc(S(=O)(=O)c2ccccc2)cc1C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.56
POLB P06746 1/20 0.56
TSHR P16473 1/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KDM4E B2RXH2 1/20 0.50
HSD17B10 Q99714 1/20 0.50
LMNA P02545 2/20 0.48
RAB9A P51151 1/20 0.48
GAA P10253 3/20 0.48
HSD11B1 P28845 1/20 0.48
HTR6 P50406 1/20 0.47
PDE4B Q07343 1/20 0.47
PLA2G2A P14555 1/20 0.46
PKM P14618 1/20 0.45
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44

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
SCHEMBL8237230 0.88 MAPK1 (0.54) MAPK1POLBTSHRMEN1KMT2A
SCHEMBL16797504 0.82 MAPK1 (0.81) MAPK1POLBTSHRMEN1KMT2A
SCHEMBL13479227 0.82 POLB (0.51) MAPK1POLBTSHRMEN1KMT2A
SCHEMBL30219287 0.81 SMN1; SMN2 (0.57) MAPK1POLBTSHRMEN1KMT2A
SCHEMBL11408239 0.81 GAA (0.65) MAPK1POLBTSHRMEN1KMT2A
SCHEMBL29598834 0.81 GAA (0.65) MAPK1POLBTSHRMEN1KMT2A
SCHEMBL3344597 0.81 SMN1; SMN2 (0.57) MAPK1POLBTSHRMEN1KMT2A
Hydrochloric Acid SCHEMBL31532317 0.80 SMN1; SMN2 (0.56) MAPK1POLBTSHRMEN1KMT2A
Hydrochloric Acid SCHEMBL11537120 0.80 GAA (0.63) MAPK1POLBTSHRMEN1KMT2A
SCHEMBL3285978 0.80 MEN1 (0.49) MAPK1POLBTSHRMEN1KMT2A

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-1940835-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PDE4 INHIBITORS GLAXO GROUP LIMITED (GB) 2008-07-09 EP disclosed
WO-2007036733-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PDE4 INHIBITORS GLAXO GROUP LIMITED (GB) 2007-04-05 WO disclosed