SCHEMBL8259952

SCHEMBL8259952

CO[C@H]1CN(CC(=O)Nc2ccc(-n3ccccc3=O)cc2)C[C@@H]1NC(=O)c1ccc(Cl)s1

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 20/20 0.78
▸ F2 P00734 1/20 0.57
▸ F11 P03951 1/20 0.57

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
SCHEMBL8258146 0.88 F10 (1.00) F10
SCHEMBL13110326 0.82 F10 (0.62) F10F2
SCHEMBL5432357 0.81 F10 (0.76) F10F2F11
SCHEMBL5630650 0.81 F10 (0.76) F10F2F11
SCHEMBL5630655 0.81 F10 (0.76) F10F2F11
SCHEMBL8258241 0.81 F10 (1.00) F10
SCHEMBL3447943 0.78 F10 (0.85) F10
SCHEMBL3447938 0.78 F10 (0.85) F10
SCHEMBL8257259 0.78 F10 (1.00) F10
SCHEMBL8255935 0.78 F10 (1.00) 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
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