SCHEMBL7488161

SCHEMBL7488161

Cc1nc(Cn2nc(-c3c(-c4ccccc4)nn4ccccc34)ccc2=O)cs1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.57
IGF1R P08069 2/20 0.43
MAPK1 P28482 5/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.38
MET P08581 1/20 0.38
PDE4B Q07343 1/20 0.37
PDE3A Q14432 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPK3 P27361 1/20 0.37
MAPK14 Q16539 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL7304113 0.81 ADORA1 (0.68) ADORA1IGF1RMAPK1PTGDR2PDE4B
SCHEMBL3616432 0.78 ADORA1 (0.59) ADORA1IGF1RMAPK1PTGDR2PDE4B
SCHEMBL8810012 0.78 ADORA1 (0.73) ADORA1IGF1RMAPK1KDM4EHSD17B10
SCHEMBL7291999 0.78 ADORA1 (0.63) ADORA1IGF1RMAPK1PTGDR2PDE4B
SCHEMBL8639797 0.77 ADORA1 (0.72) ADORA1IGF1RMAPK1PTGDR2KDM4E
SCHEMBL19829271 0.77 ADORA1 (0.66) ADORA1IGF1RMAPK1PDE4BPDE3A
SCHEMBL7295203 0.76 ADORA1 (0.73) ADORA1IGF1RMAPK1PDE4BPDE3A
SCHEMBL7299166 0.76 ADORA1 (0.77) ADORA1IGF1RMAPK1KDM4EMAPK3
SCHEMBL7301059 0.76 ADORA1 (0.67) ADORA1IGF1RMAPK1PTGDR2PDE4B
Hydrochloric Acid SCHEMBL7301696 0.75 ADORA1 (0.68) ADORA1IGF1RMAPK1KDM4EMAPK3

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-0925299-B1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO (JP) 2002-09-25 EP disclosed
US-6124456-A Pyrazolopyridine compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-09-26 US disclosed
EP-0925299-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-06-30 EP disclosed
WO-1998003507-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-29 WO disclosed