SCHEMBL8259245

SCHEMBL8259245

O=C(N[C@H]1CNC[C@@H]1O)c1ccc(Cl)s1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 12/20 0.55
▸ KMT2A Q03164 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ F2 P00734 4/20 0.46
▸ MAPK1 P28482 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ GSK3B P49841 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
SCHEMBL13461888 0.82 F10 (0.55) F10KMT2ASMN1; SMN2MEN1GAA
SCHEMBL3309272 0.81 F10 (0.51) F10KMT2AMEN1F2MAPK1
SCHEMBL3309265 0.81 F10 (0.51) F10KMT2AMEN1F2MAPK1
SCHEMBL8259083 0.79 MAPK1 (0.47) F10MAPK1LMNAGSK3B
SCHEMBL3545702 0.76 F10 (0.57) F10KMT2ASMN1; SMN2MEN1GAA
SCHEMBL3450499 0.76 F10 (0.47) F10KMT2ASMN1; SMN2MEN1RAB9A
SCHEMBL8305363 0.75 F10 (0.54) F10KMT2ASMN1; SMN2MEN1GAA
SCHEMBL4691317 0.75 F10 (0.54) F10KMT2ASMN1; SMN2MEN1GAA
SCHEMBL8354818 0.75 F10 (0.54) F10KMT2ASMN1; SMN2MEN1GAA
SCHEMBL8257466 0.75 SMN1; SMN2 (0.49) F10KMT2ASMN1; SMN2MEN1GAA

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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