SCHEMBL7280226

SCHEMBL7280226

CCOC(=O)C1=C(C)Nc2c(c(-c3ccccc3)nn2C)C1c1cccc(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.52
BCHE P06276 1/20 0.49
CACNA1D Q01668 4/20 0.48
CACNA1F O60840 2/20 0.48
CACNA1S Q13698 2/20 0.48
CACNA1C Q13936 2/20 0.48
ALDH1A1 P00352 4/20 0.47
GAA P10253 3/20 0.47
ADORA3 P0DMS8 1/20 0.47
HTT P42858 1/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 2/20 0.46
KDM4E B2RXH2 2/20 0.45
HPGD P15428 2/20 0.45
LMNA P02545 2/20 0.45
HSD17B10 Q99714 2/20 0.45
ABCB1 P08183 1/20 0.44
SIRT3 Q9NTG7 1/20 0.44

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
SCHEMBL7273692 0.88 ACHE (0.56) ACHEBCHECACNA1DCACNA1FCACNA1S
SCHEMBL7282043 0.85 CACNA1F (0.64) ACHECACNA1DCACNA1FCACNA1SCACNA1C
SCHEMBL10572886 0.84 CACNA1F (0.60) ACHECACNA1DCACNA1FCACNA1SCACNA1C
SCHEMBL7272932 0.81 CACNA1C (0.53) ACHECACNA1DCACNA1FCACNA1SCACNA1C
SCHEMBL7272599 0.80 CACNA1D (0.49) ACHECACNA1DCACNA1FCACNA1SCACNA1C
SCHEMBL7281990 0.79 ADORA3 (0.58) ACHECACNA1DCACNA1FCACNA1SCACNA1C
SCHEMBL10576521 0.78 CACNA1F (0.61) ACHECACNA1DCACNA1FCACNA1SCACNA1C
SCHEMBL10578436 0.78 HIF1A (0.62) ACHECACNA1DCACNA1FCACNA1SCACNA1C
SCHEMBL7280662 0.78 MAPT (0.57) ACHECACNA1CADORA3HTTTP53
SCHEMBL10574483 0.77 CACNA1F (0.60) ACHECACNA1DCACNA1FCACNA1SCACNA1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0114273-B1 NEW PHARMACOLOGICALLY ACTIVE PYRAZOLOPYRIDINES GRUPPO LEPETIT S.p.A. (IT) 1991-11-06 EP disclosed
US-4954508-A HYPOTENSIVE GRUPPO LEPETIT S.P.A. (IT) 1990-09-04 US disclosed
EP-0114273-A1 New pharmacologically active pyrazolopyridines GRUPPO LEPETIT S.p.A. (IT) 1984-08-01 EP disclosed