SCHEMBL7378795

SCHEMBL7378795

CC(=O)OC(C)c1nccc2[nH]c(=O)ccc12

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 18/20 0.57
PDE3A Q14432 18/20 0.57
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL10810836 0.79 PDE3B (0.71) PDE3BPDE3A
SCHEMBL6293376 0.74 PDE3B (0.39) PDE3BPDE3AALDH1A1HSD17B10
SCHEMBL6293377 0.74 PDE3B (0.39) PDE3BPDE3AALDH1A1HSD17B10
SCHEMBL22864120 0.72 PDE3B (1.00) PDE3BPDE3A
SCHEMBL7381637 0.71 PDE3B (0.62) PDE3BPDE3AKDM4E
SCHEMBL22864122 0.70 PDE3B (0.61) PDE3BPDE3A
SCHEMBL7382500 0.69 PDE3B (0.63) PDE3BPDE3AALDH1A1KDM4E
SCHEMBL22864119 0.68 PDE3B (0.53) PDE3BPDE3A
SCHEMBL29593785 0.68 PDE3B (0.53) PDE3BPDE3A
SCHEMBL29662022 0.68 PDE3B (0.53) PDE3BPDE3A

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-0134535-B1 1,6-NAPHTHYRIDIN DERIVATIVES USEFUL AS CARDIOTONICS AND PREPARATION THEREOF STERLING DRUG INC. (US) 1988-10-26 EP disclosed
US-4604399-A 5-methyl(or ethyl)-1,6-naphthyridin-2(1H)-one 6-oxides, their preparation and the cardiotonic use thereof STERLING DRUG INC. (US) 1986-08-05 US disclosed
US-4532247-A Increases cardiac contractility STERLING DRUG INC. (US) 1985-07-30 US disclosed
EP-0134535-A1 1,6-Naphthyridin derivatives useful as cardiotonics and preparation thereof STERLING DRUG INC. (US) 1985-03-20 EP disclosed