SCHEMBL7203519

SCHEMBL7203519

CC(C)(C)OC(=O)NCCCNCCN

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.64
▸ MAOB P27338 1/20 0.64
▸ TDP1 Q9NUW8 1/20 0.59
▸ MEN1 O00255 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ CA2 P00918 12/20 0.49
▸ CA1 P00915 11/20 0.49
▸ CA12 O43570 8/20 0.49
▸ CA9 Q16790 8/20 0.49
▸ STK17B O94768 1/20 0.44
▸ STK17A Q9UEE5 1/20 0.44
▸ CA3 P07451 1/20 0.43
▸ CA4 P22748 1/20 0.43
▸ CA6 P23280 1/20 0.43
▸ CA5A P35218 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ CA14 Q9ULX7 1/20 0.43
▸ CA5B Q9Y2D0 1/20 0.43
▸ EPHX1 P07099 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
SCHEMBL12502050 0.95 MAOA (0.62) MAOAMAOBTDP1MEN1GAA
SCHEMBL29778251 0.95 MAOA (0.62) MAOAMAOBTDP1MEN1GAA
SCHEMBL1419813 0.93 MAOA (0.65) MAOAMAOBTDP1MEN1GAA
SCHEMBL1273886 0.93 MAOA (0.65) MAOAMAOBTDP1MEN1GAA
SCHEMBL17263661 0.93 MAOA (0.69) MAOAMAOBTDP1MEN1GAA
SCHEMBL19965900 0.93 MAOA (0.60) MAOAMAOBTDP1MEN1GAA
SCHEMBL1557057 0.93 TDP1 (0.67) MAOAMAOBTDP1MEN1GAA
Hydrochloric Acid SCHEMBL8724039 0.92 MAOA (0.63) MAOAMAOBTDP1MEN1GAA
SCHEMBL9726174 0.92 MAOA (0.68) MAOAMAOBTDP1MEN1GAA
SCHEMBL10688506 0.92 MAOA (0.68) MAOAMAOBTDP1MEN1GAA

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
WO-2003048315-A2 ANTISENSE MODULATION OF MDM2 EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2003-06-12 — — WO disclosed
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