SCHEMBL7384124

SCHEMBL7384124

CCCCCCCC(=O)OCc1nccc2[nH]c(=O)ccc12

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 10/20 0.56
PDE3A Q14432 10/20 0.56
ELANE P08246 2/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
DGKA P23743 1/20 0.38
GPR84 Q9NQS5 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
MMP12 P39900 1/20 0.38
P2RX7 Q99572 1/20 0.38

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
SCHEMBL7373709 0.99 PDE3B (0.57) PDE3BPDE3AELANEKDM4EALDH1A1
SCHEMBL7376102 0.92 PDE3B (0.63) PDE3BPDE3AKDM4E
SCHEMBL7381637 0.80 PDE3B (0.62) PDE3BPDE3AKDM4E
SCHEMBL7382500 0.78 PDE3B (0.63) PDE3BPDE3AKDM4EALDH1A1TRPV1
SCHEMBL10810746 0.73 PDE3B (1.00) PDE3BPDE3A
SCHEMBL7378876 0.70 PDE3B (1.00) PDE3BPDE3A
SCHEMBL7381346 0.70 PDE3B (0.61) PDE3BPDE3A
Bromide SCHEMBL11462475 0.68 LMNA (0.47) ELANEKDM4EALDH1A1LMNATSHR
Hydrochloric Acid SCHEMBL11271798 0.68 LMNA (0.47) ELANEKDM4EALDH1A1LMNATSHR
SCHEMBL3814877 0.67 DGKA (0.60) ELANEKDM4EALDH1A1LMNATSHR

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