SCHEMBL8052240

SCHEMBL8052240

CC(C)C(=O)OCOC(=O)C1CC(C)(C)N([O])C1(C)C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC18A2 Q05940 1/20 0.32

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
SCHEMBL3051796 0.85
SCHEMBL8057159 0.84
SCHEMBL8052210 0.82
SCHEMBL8051588 0.81 NLRP3 (0.32)
SCHEMBL3057229 0.80 SLC18A2 (0.30) SLC18A2
SCHEMBL7936712 0.80 MAPT (0.37)
SCHEMBL3049653 0.77 SLC18A2 (0.32) SLC18A2
SCHEMBL8052046 0.76 ALDH1A1 (0.34)
SCHEMBL3058283 0.75
SCHEMBL1433982 0.74 ATM (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0995740-A1 NOVEL NITROXYL COMPOUNDS AND DRUGS AND REAGENTS CONTAINING THE SAME AS THE ACTIVE INGREDIENT DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 2000-04-26 EP disclosed