SCHEMBL27748285

SCHEMBL27748285

CC(C)CCC(=O)COP(C)(C)=O

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.40

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
SCHEMBL8824105 0.74 CA1 (0.46) CA1
SCHEMBL110531 0.72 CA1 (0.60) CA1
SCHEMBL27748334 0.72
SCHEMBL25785297 0.71 TDP1 (0.49) CA1
SCHEMBL8823881 0.71 CA1 (0.43) CA1
Fluoride SCHEMBL28026874 0.70 CA1 (0.57) CA1
SCHEMBL14350722 0.70 CA1 (0.57) CA1
SCHEMBL11296124 0.70
SCHEMBL8124886 0.69 CA1 (0.41) CA1
SCHEMBL17898557 0.69 CA1 (0.38) CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101484428-B Alkyl-pyridazine derivatives as inhibitors of 11 beta hydroxysteroid dehydrogenase type 1(11b-HSD 1) HOFFMANN LA ROCHE 2011-11-16 CN disclosed
CN-101484428-A Alkyl-pyridazine derivatives as inhibitors of 11 beta hydroxysteroid dehydrogenase type 1(11b-HSD 1) HOFFMANN LA ROCHE (CH) 2009-07-15 CN disclosed