SCHEMBL4592885

SCHEMBL4592885

CO[C@@H]1CN(C(N)=O)C[C]1CC(=O)Nc1ccc(N2CCOCC2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 19/20 0.48
▸ P2RX4 Q99571 1/20 0.42

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
SCHEMBL4592257 0.87 F10 (0.46) F10
SCHEMBL3450659 0.75 F10 (0.48) F10
SCHEMBL6453826 0.75 F10 (0.64) F10
SCHEMBL4592227 0.74 MAPK10 (0.39) F10
SCHEMBL3450661 0.74 F10 (0.51) F10
SCHEMBL1679321 0.74 F10 (0.65) F10
SCHEMBL118728 0.72 F10 (0.58) F10
SCHEMBL28407706 0.72 F10 (0.59) F10
SCHEMBL1380646 0.72 F10 (0.62) F10
SCHEMBL4592889 0.71 F10 (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1877404-A2 NOVEL CYCLIC AMINES F. Hoffmann-Roche AG (CH) 2008-01-16 — — EP disclosed
WO-2006114401-A2 NOVEL CYCLIC AMINES F. HOFFMANN-LA ROCHE AG (CH) 2006-11-02 — — WO disclosed
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