SCHEMBL7895774

SCHEMBL7895774

CC(=O)NC1CCN(C(N)=O)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 10/20 0.49
EPHX1 P07099 4/20 0.49
DPP4 P27487 1/20 0.44
DPP8 Q6V1X1 1/20 0.44
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
ALDH1A1 P00352 2/20 0.42
ATM Q13315 1/20 0.41
KDM1A O60341 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
KDM4E B2RXH2 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL9893075 0.83 EPHX2 (0.67) EPHX2EPHX1
SCHEMBL5361247 0.82 EPHX2 (0.50) EPHX2EPHX1DPP4DPP8CA1
SCHEMBL18559935 0.82 EPHX2 (0.50) EPHX2EPHX1DPP4DPP8CA1
SCHEMBL23573522 0.82 EPHX1 (0.42) EPHX2EPHX1ALDH1A1KDM1AMAOA
SCHEMBL14366334 0.80 EPHX2 (0.49) EPHX2EPHX1DPP4DPP8CA1
SCHEMBL23011884 0.80 EPHX2 (0.41) EPHX2EPHX1ALDH1A1KDM1AMAOA
SCHEMBL12846737 0.79 EPHX2 (0.49) EPHX2EPHX1
SCHEMBL12545762 0.79 EPHX2 (0.45) EPHX2EPHX1ALDH1A1
SCHEMBL13654292 0.79 ATM (0.44) EPHX2EPHX1DPP4DPP8CA1
SCHEMBL12812332 0.79 KDM1A (0.42) EPHX2EPHX1ALDH1A1ATMKDM1A

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
EP-2373634-B1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARM CO LTD (JP) 2015-11-11 EP disclosed
WO-2010065717-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-06-10 WO disclosed
WO-2005090354-A1 PYRAZOLO[3,4-b] PYRIDINE COMPOUNDS, AND THEIR USE AS PDE4 INHIBITORS GLAXO GROUP LIMITED (GB) 2005-09-29 WO disclosed