SCHEMBL8808692

SCHEMBL8808692

O=c1ccc(-c2c(-c3ccccc3)nn3ccccc23)nn1CCCO

nearest known ligand 0.80

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.80
MAPK1 P28482 6/20 0.51
IGF1R P08069 2/20 0.48
MAPK3 P27361 1/20 0.41
MAPK14 Q16539 1/20 0.41
EGFR P00533 1/20 0.40
KDM4E B2RXH2 2/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
AKT1 P31749 1/20 0.39

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
SCHEMBL7294123 0.97 ADORA1 (0.79) ADORA1MAPK1IGF1RMAPK3MAPK14
SCHEMBL7299166 0.93 ADORA1 (0.77) ADORA1MAPK1IGF1RMAPK3MAPK14
SCHEMBL2641189 0.89 ADORA1 (1.00) ADORA1MAPK1IGF1RKDM4EHTT
SCHEMBL19829272 0.88 ADORA1 (0.86) ADORA1MAPK1IGF1REGFRKDM4E
SCHEMBL8807647 0.88 ADORA1 (0.94) ADORA1MAPK1IGF1RKDM4EHTT
SCHEMBL7303206 0.87 ADORA1 (0.74) ADORA1MAPK1IGF1RMAPK3MAPK14
SCHEMBL7290705 0.87 ADORA1 (0.74) ADORA1MAPK1IGF1RMAPK3MAPK14
SCHEMBL7301601 0.87 ADORA1 (0.74) ADORA1MAPK1IGF1RMAPK3MAPK14
SCHEMBL7295163 0.87 ADORA1 (0.74) ADORA1MAPK1IGF1RMAPK3MAPK14
SCHEMBL7299845 0.87 ADORA1 (0.74) ADORA1MAPK1IGF1RMAPK3MAPK14

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-0379979-B1 Pyrazolopyridine compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1997-03-19 EP disclosed
US-5155114-A Treating or preventing renal toxicity, nephrosis, nephritis FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-10-13 US disclosed
US-4985444-A Pyrazolopyridine compound and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-01-15 US disclosed
EP-0379979-A1 Pyrazolopyridine compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-08-01 EP disclosed