SCHEMBL1379341

SCHEMBL1379341

NS(=O)(=O)OCCC(=O)Nc1ccc(N2CCOCC2=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.55
P2RX4 Q99571 2/20 0.49
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46

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
SCHEMBL1380646 0.83 F10 (0.62) F10
SCHEMBL8324993 0.82 F10 (0.59) F10P2RX4
SCHEMBL1381539 0.82 F10 (0.59) F10
SCHEMBL1379173 0.81 F10 (0.57) F10CA1CA2CA9
SCHEMBL6179994 0.80 F10 (0.59) F10CA1CA2CA9
SCHEMBL1383122 0.80 F10 (0.60) F10P2RX4
SCHEMBL6453826 0.79 F10 (0.64) F10
SCHEMBL6181035 0.79 F10 (0.60) F10
SCHEMBL1679321 0.78 F10 (0.65) F10
SCHEMBL1380603 0.78 F10 (0.59) F10

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-4699985-B2 2011-06-15 JP claimed