SCHEMBL8260042

SCHEMBL8260042

CO[C@H]1CN(CC(=O)Nc2ccc(N3CCOCC3=O)cc2F)C[C@@H]1NC(=O)c1ccc(Cl)s1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 20/20 0.72

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
SCHEMBL8260030 0.91 F10 (0.72) F10
SCHEMBL13110326 0.88 F10 (0.62) F10
SCHEMBL8258146 0.83 F10 (1.00) F10
SCHEMBL8260493 0.82 F10 (0.81) F10
SCHEMBL3447220 0.81 F10 (0.49) F10
SCHEMBL13436054 0.78 F10 (0.57) F10
SCHEMBL8256107 0.78 F10 (0.62) F10
SCHEMBL8258241 0.77 F10 (1.00) F10
SCHEMBL8257259 0.76 F10 (1.00) F10
SCHEMBL5626218 0.75 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820699-B2 Cyclic amines HOFFMANN-LA ROCHE INC. (US) 2010-10-26 — — US disclosed
US-7820699-B2 Cyclic amines HOFFMANN-LA ROCHE INC. (US) 2010-10-26 — — US disclosed
WO-2006114401-A2 NOVEL CYCLIC AMINES F. HOFFMANN-LA ROCHE AG (CH) 2006-11-02 — — WO disclosed
Send feedback