SCHEMBL7463266

SCHEMBL7463266

CCOC(=O)c1ccc(N2CCC[C@H](N)C2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 1/20 0.47
MAP4K4 O95819 1/20 0.47
PIM1 P11309 1/20 0.47
CLK2 P49760 1/20 0.47
MAP4K2 Q12851 1/20 0.47
CAMK2D Q13557 1/20 0.47
DYRK1A Q13627 1/20 0.47
PIM3 Q86V86 1/20 0.47
AURKB Q96GD4 1/20 0.47
PRKD2 Q9BZL6 1/20 0.47
CLK4 Q9HAZ1 1/20 0.47
STK17A Q9UEE5 1/20 0.47
MAP4K5 Q9Y4K4 1/20 0.47
DPP4 P27487 5/20 0.47
MAPT P10636 4/20 0.46
MAPK1 P28482 2/20 0.46
HTT P42858 1/20 0.46
KDM4E B2RXH2 1/20 0.44
TSHR P16473 2/20 0.43
ALDH1A1 P00352 2/20 0.43

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
SCHEMBL7467833 0.89 PRKD3 (0.48) PRKD3MAP4K4PIM1CLK2MAP4K2
SCHEMBL7052910 0.87 PRKD3 (0.47) PRKD3MAP4K4PIM1CLK2MAP4K2
SCHEMBL7468709 0.84 PRKD3 (0.45) PRKD3MAP4K4PIM1CLK2MAP4K2
SCHEMBL7051582 0.81 DPP4 (0.56) PRKD3MAP4K4PIM1CLK2MAP4K2
SCHEMBL7468160 0.81 DPP4 (0.56) PRKD3MAP4K4PIM1CLK2MAP4K2
SCHEMBL7470666 0.79 OPRK1 (0.49) MAPTMAPK1HTTKDM4ETSHR
SCHEMBL7463261 0.79 CASP3 (0.42) MAPTMAPK1HTTKDM4ETSHR
SCHEMBL30596364 0.75 NOTUM (0.52) DPP4MAPTLMNASUV39H2L3MBTL1
SCHEMBL29087311 0.75 NOTUM (0.52) DPP4MAPTLMNASUV39H2L3MBTL1
SCHEMBL383362 0.73 PRKD3 (0.56) PRKD3MAP4K4PIM1CLK2MAP4K2

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
EP-1227083-A1 3-AMINOPIPERIDINE DERIVATIVES AS INTEGRIN $g(a)v$g(b)3 ANTAGONISTS MEIJI SEIKA KAISHA LTD. (JP) 2002-07-31 EP disclosed