SCHEMBL9687419

SCHEMBL9687419

CC(=O)OC1CCCCCC(=O)CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.42
TRIM33 Q9UPN9 2/20 0.42
ALDH1A1 P00352 1/20 0.42
EPHX1 P07099 2/20 0.42
NAAA Q02083 2/20 0.39
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
MMP12 P39900 1/20 0.38
HTT P42858 1/20 0.38
CYP19A1 P11511 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2C19 P33261 1/20 0.36
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 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
SCHEMBL5167284 0.85 EPHX1 (0.52) EPHX1NAAAMMP1MMP9MMP12
SCHEMBL19063411 0.85 EPHX1 (0.52) EPHX1NAAAMMP1MMP9MMP12
SCHEMBL11098598 0.85 EPHX1 (0.52) EPHX1NAAAMMP1MMP9MMP12
SCHEMBL23506964 0.85 EPHX1 (0.52) EPHX1NAAAMMP1MMP9MMP12
SCHEMBL200090 0.85 EPHX1 (0.52) EPHX1NAAAMMP1MMP9MMP12
SCHEMBL23018499 0.85 EPHX1 (0.52) EPHX1NAAAMMP1MMP9MMP12
SCHEMBL93396 0.85 EPHX1 (0.52) EPHX1NAAAMMP1MMP9MMP12
SCHEMBL1695496 0.85 EPHX1 (0.52) EPHX1NAAAMMP1MMP9MMP12
SCHEMBL22540554 0.85 EPHX1 (0.52) EPHX1NAAAMMP1MMP9MMP12
SCHEMBL31570134 0.85 EPHX1 (0.52) EPHX1NAAAMMP1MMP9MMP12

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-0270494-B1 Certain cycloalka- [b]-pyrazolo-[3,4-d]-pyridin-3-one derivatives CIBA-GEIGY AG (CH) 1992-08-19 EP disclosed
US-4826854-A Certain cycloalka-(b)-pyrazolo(3,4-d)-pyridin-3-one derivatives CIBA-GEIGY CORPORATION (US) 1989-05-02 US disclosed
EP-0270494-A2 Certain cycloalka- [b]-pyrazolo-[3,4-d]-pyridin-3-one derivatives CIBA-GEIGY AG (CH) 1988-06-08 EP disclosed