SCHEMBL1679537

SCHEMBL1679537

NC(=O)Cc1ccc(N2CCOCC2=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.52
F2 P00734 1/20 0.46
PTGS2 P35354 5/20 0.45

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
SCHEMBL76302 0.87 F10 (0.50) F10F2PTGS2
SCHEMBL1675832 0.86 F10 (0.50) F10PTGS2
SCHEMBL1675780 0.84 F10 (0.48) F10PTGS2
SCHEMBL21753351 0.82 F10 (0.53) F10PTGS2
SCHEMBL3864241 0.82 F10 (0.60) F10PTGS2
SCHEMBL2639481 0.81 F10 (0.52) F10PTGS2
SCHEMBL85537 0.80 LIPE (0.52) F10F2
SCHEMBL1675756 0.79 F10 (0.46) F10F2
SCHEMBL7906874 0.79 F10 (0.53) F10PTGS2
SCHEMBL21753376 0.79 F10 (0.53) F10PTGS2

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
JP-4668614-B2 2011-04-13 JP claimed