SCHEMBL3708167

SCHEMBL3708167

CCOC(=O)c1sc(-c2ccc3c(c2)c(/C=N\O)cn3CC2CC2)nc1C

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.44
DBF4 Q9UBU7 1/20 0.44
ICMT O60725 5/20 0.41
XDH P47989 2/20 0.39
TRPM8 Q7Z2W7 6/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
KMT2A Q03164 2/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL3708168 1.00 CDC7 (0.44) CDC7DBF4ICMTXDHTRPM8
SCHEMBL3708169 1.00 CDC7 (0.44) CDC7DBF4ICMTXDHTRPM8
SCHEMBL3704887 0.91 CDC7 (0.46) CDC7DBF4ICMTXDHTRPM8
SCHEMBL3707266 0.83 XDH (0.57) CDC7DBF4ICMTXDH
SCHEMBL3715827 0.83 CDC7 (0.47) CDC7DBF4XDHTRPM8KDM4E
SCHEMBL3715828 0.83 CDC7 (0.47) CDC7DBF4XDHTRPM8KDM4E
SCHEMBL3715829 0.83 CDC7 (0.47) CDC7DBF4XDHTRPM8KDM4E
SCHEMBL3714294 0.82 CDC7 (0.45) CDC7DBF4ICMTXDHTRPM8
SCHEMBL3715575 0.80 CDC7 (0.52) CDC7DBF4TRPM8KDM4EALDH1A1
SCHEMBL3706584 0.80 XDH (0.55) CDC7DBF4XDH

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 2 patents. 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
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