SCHEMBL7295140

SCHEMBL7295140

O=c1ccc(-c2c(-c3ccccc3)nn3ccccc23)nn1CCCCCCCBr

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.74
IGF1R P08069 2/20 0.47
MAPK1 P28482 6/20 0.44
MAPK3 P27361 1/20 0.39
MAPK14 Q16539 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 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
SCHEMBL7303206 1.00 ADORA1 (0.74) ADORA1IGF1RMAPK1MAPK3MAPK14
SCHEMBL7301601 1.00 ADORA1 (0.74) ADORA1IGF1RMAPK1MAPK3MAPK14
SCHEMBL7290705 1.00 ADORA1 (0.74) ADORA1IGF1RMAPK1MAPK3MAPK14
SCHEMBL7295163 1.00 ADORA1 (0.74) ADORA1IGF1RMAPK1MAPK3MAPK14
SCHEMBL7299845 1.00 ADORA1 (0.74) ADORA1IGF1RMAPK1MAPK3MAPK14
SCHEMBL7293632 1.00 ADORA1 (0.74) ADORA1IGF1RMAPK1MAPK3MAPK14
SCHEMBL7294123 0.88 ADORA1 (0.79) ADORA1IGF1RMAPK1MAPK3MAPK14
SCHEMBL8808692 0.87 ADORA1 (0.80) ADORA1IGF1RMAPK1MAPK3MAPK14
SCHEMBL7291645 0.87 ADORA1 (0.70) ADORA1IGF1RMAPK1MAPK3MAPK14
SCHEMBL7302512 0.87 ADORA1 (0.70) ADORA1IGF1RMAPK1MAPK3MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0497258-B1 Use of adenosine antagonists in the prevention and treatment of pancreatitis and ulcer FUJISAWA PHARMACEUTICAL CO (JP) 2002-01-02 EP disclosed
EP-0467248-B1 Pyrazolopyridine compound and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1998-10-28 EP disclosed
US-5338743-A Pancreatitis FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-08-16 US disclosed
EP-0497258-A2 Use of adenosine antagonists in the prevention and treatment of pancreatitis and ulcer FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-08-05 EP disclosed
EP-0467248-A2 Pyrazolopyridine compound and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-01-22 EP disclosed