SCHEMBL8808458

SCHEMBL8808458

O=C(O)CCN1CCC(c2c(-c3ccccc3)nn3ccccc23)=CC1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 3/20 0.52
MAPK1 P28482 3/20 0.43
AKT1 P31749 1/20 0.39
IGF1R P08069 1/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EGFR P00533 2/20 0.38
HSD17B10 Q99714 2/20 0.38
TSHR P16473 1/20 0.38
PTGIR P43119 1/20 0.36
ADORA2A P29274 3/20 0.35
ADORA2B P29275 3/20 0.35
ADORA3 P0DMS8 2/20 0.35
RAF1 P04049 1/20 0.35
GSK3B P49841 1/20 0.35

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
SCHEMBL8810287 0.89 ADORA1 (0.44) ADORA1MAPK1AKT1IGF1RKDM4E
SCHEMBL8808477 0.74 ADORA1 (0.53) ADORA1MAPK1AKT1IGF1RKDM4E
SCHEMBL8808264 0.72 ADORA1 (0.59) ADORA1MAPK1AKT1IGF1RKDM4E
SCHEMBL8807266 0.72 ADORA1 (0.88) ADORA1MAPK1AKT1IGF1RKDM4E
SCHEMBL8809607 0.71 IGF1R (0.47) ADORA1MAPK1AKT1IGF1REGFR
SCHEMBL8807259 0.71 ADORA1 (0.57) ADORA1MAPK1AKT1IGF1RKDM4E
SCHEMBL8808089 0.70 ADORA1 (0.64) ADORA1MAPK1AKT1IGF1RKDM4E
SCHEMBL8809176 0.69 ADORA1 (0.52) ADORA1MAPK1AKT1IGF1RKDM4E
SCHEMBL2641189 0.69 ADORA1 (1.00) ADORA1MAPK1IGF1RKDM4EHSD17B10
SCHEMBL8807647 0.68 ADORA1 (0.94) ADORA1MAPK1IGF1RKDM4EHSD17B10

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