SCHEMBL7884445

SCHEMBL7884445

CCOC(=O)c1cnc(-c2ccc3c(c2)c(N)cn3CC2CC2)s1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 2/20 0.48
DBF4 Q9UBU7 2/20 0.48
ICMT O60725 8/20 0.47
XDH P47989 1/20 0.39
LMNA P02545 1/20 0.36
DYRK1A Q13627 2/20 0.35
GSK3B P49841 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35

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
SCHEMBL7886314 0.90 ICMT (0.43) CDC7DBF4ICMTXDHCNR1
SCHEMBL3705167 0.87 XDH (0.55) CDC7DBF4ICMTXDH
SCHEMBL7894648 0.87 ICMT (0.45) ICMTXDHGSK3BCNR1CNR2
SCHEMBL7895901 0.81 CDC7 (0.52) CDC7DBF4XDH
SCHEMBL7890347 0.80 CDC7 (0.45) CDC7DBF4DYRK1A
SCHEMBL3707802 0.75 CDC7 (0.51) CDC7DBF4XDH
SCHEMBL3707314 0.74 XDH (0.49) CDC7DBF4XDH
SCHEMBL3715619 0.73 XDH (0.58) XDH
SCHEMBL7883332 0.73 CDC7 (0.56) CDC7DBF4ICMT
SCHEMBL3704109 0.72 XDH (0.55) CDC7DBF4ICMTXDH

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-2010093191-A2 NOVEL COMPOUNDS EFFECTIVE AS XANTHINE OXIDASE INHIBITORS, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2010-08-19 WO disclosed