SCHEMBL8808149

SCHEMBL8808149

CCOC(=O)CCCn1nc(-c2c(-c3ccccc3)nn3ccccc23)ccc1=O

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.77
HTT P42858 1/20 0.52
HSD17B10 Q99714 3/20 0.47
CYP1A2 P05177 1/20 0.47
ALDH1A1 P00352 2/20 0.47
EGFR P00533 1/20 0.46
GAA P10253 2/20 0.45
MAPK1 P28482 1/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
IGF1R P08069 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
FAAH O00519 2/20 0.41

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
SCHEMBL8812217 0.97 ADORA1 (0.73) ADORA1HTTHSD17B10CYP1A2ALDH1A1
SCHEMBL9007316 0.96 ADORA1 (0.72) ADORA1HTTHSD17B10CYP1A2ALDH1A1
SCHEMBL19829272 0.88 ADORA1 (0.86) ADORA1HTTHSD17B10EGFRMAPK1
SCHEMBL2641189 0.87 ADORA1 (1.00) ADORA1HTTHSD17B10MAPK1KDM4E
SCHEMBL7290695 0.86 ADORA1 (0.62) ADORA1HTTHSD17B10CYP1A2ALDH1A1
SCHEMBL8808083 0.85 ADORA1 (0.73) ADORA1HTTHSD17B10CYP1A2ALDH1A1
SCHEMBL8807647 0.84 ADORA1 (0.94) ADORA1HTTHSD17B10MAPK1KDM4E
SCHEMBL7292843 0.84 ADORA1 (0.72) ADORA1HTTHSD17B10CYP1A2EGFR
SCHEMBL7290693 0.84 ADORA1 (0.64) ADORA1HTTHSD17B10CYP1A2ALDH1A1
SCHEMBL8807266 0.83 ADORA1 (0.88) ADORA1HTTHSD17B10CYP1A2MAPK1

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