SCHEMBL18650423

SCHEMBL18650423

CN1CCN(C2CCN(N=O)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.38
L3MBTL3 Q96JM7 2/20 0.38
ALDH1A1 P00352 2/20 0.36
PIM1 P11309 1/20 0.35
ACHE P22303 1/20 0.34
KDM4E B2RXH2 1/20 0.33
RAD52 P43351 1/20 0.33
TGM2 P21980 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
USP5 P45974 1/20 0.32
KCNH2 Q12809 1/20 0.30
SIGMAR1 Q99720 2/20 0.30
ACVR1 Q04771 1/20 0.30
VCP P55072 1/20 0.30

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
SCHEMBL3436969 0.79 L3MBTL1 (0.46) L3MBTL1L3MBTL3ALDH1A1PIM1ACHE
SCHEMBL23269640 0.77 L3MBTL1 (0.44) L3MBTL1L3MBTL3ALDH1A1PIM1ACHE
SCHEMBL14307143 0.77 L3MBTL1 (0.44) L3MBTL1L3MBTL3ALDH1A1PIM1ACHE
SCHEMBL22519024 0.77 L3MBTL1 (0.41) L3MBTL1L3MBTL3ALDH1A1PIM1ACHE
SCHEMBL11623926 0.77
SCHEMBL81624 0.77 L3MBTL1 (0.39) L3MBTL1L3MBTL3ALDH1A1PIM1ACHE
SCHEMBL26042916 0.77 L3MBTL3 (0.47) L3MBTL1L3MBTL3ALDH1A1PIM1ACHE
SCHEMBL25171600 0.76 POLB (0.40) L3MBTL1L3MBTL3ALDH1A1KDM4EHRH3
SCHEMBL18650425 0.75 SMN1; SMN2 (0.44) L3MBTL1L3MBTL3ALDH1A1ACHEKDM4E
SCHEMBL12772837 0.74 L3MBTL3 (0.46) L3MBTL1L3MBTL3ALDH1A1PIM1KDM4E

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-2017045648-A1 PREPARATION METHOD FOR DEUTERATED COMPOUND 正大天晴药业集团股份有限公司 2017-03-23 WO disclosed