SCHEMBL2957849

SCHEMBL2957849

CB(O)OC1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA12 O43570 2/20 0.34
CA9 Q16790 2/20 0.34
NAAA Q02083 2/20 0.34
EPHX1 P07099 2/20 0.33
ACHE P22303 1/20 0.31

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
SCHEMBL1553827 0.80 CA1 (0.44) CA1CA2CA12CA9NAAA
SCHEMBL29006344 0.78 CA1 (0.37) CA1CA2CA12CA9NAAA
SCHEMBL28716435 0.78 CA1 (0.37) CA1CA2CA12CA9NAAA
SCHEMBL30838778 0.78 CA1 (0.37) CA1CA2CA12CA9NAAA
SCHEMBL29161823 0.78 CA1 (0.37) CA1CA2CA12CA9NAAA
SCHEMBL12980150 0.78 CA1 (0.33) CA1CA2CA12CA9NAAA
SCHEMBL2341384 0.78 CA1 (0.37) CA1CA2CA12CA9NAAA
SCHEMBL29433 0.78 CA1 (0.42) CA1CA2CA12CA9NAAA
SCHEMBL1014426 0.78 CA1 (0.37) CA1CA2CA12CA9NAAA
SCHEMBL30838782 0.78 CA1 (0.37) CA1CA2CA12CA9NAAA

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
WO-2010111406-A2 COMPOUNDS AND THERAPEUTIC USES THEREOF MYRIAD PHARMACEUTICALS, INC. (US) 2010-09-30 WO disclosed