SCHEMBL3709065

SCHEMBL3709065

CCOC(=O)c1sc(-c2ccc3[nH]c(C)c(C#N)c3c2)nc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 3/20 0.53
DBF4 Q9UBU7 3/20 0.53
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.45
LMNA P02545 1/20 0.45
TRPM8 Q7Z2W7 6/20 0.45
HCRTR1 O43613 1/20 0.44
MAPT P10636 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
FNTA P49354 3/20 0.43
FNTB P49356 3/20 0.43
XDH P47989 2/20 0.43
ABCC4 O15439 1/20 0.43
ABCB11 O95342 1/20 0.43
PGR P06401 1/20 0.43
CHRM1 P11229 1/20 0.43
PDE4A P27815 1/20 0.43
BLVRB P30043 1/20 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
SCHEMBL3707182 0.85 CDC7 (0.55) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3710122 0.84 CDC7 (0.53) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3710152 0.84 CDC7 (0.53) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL7890591 0.84 CDC7 (0.53) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3717089 0.83 CDC7 (0.52) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3710158 0.81 CDC7 (0.50) CDC7DBF4KDM4EALDH1A1HPGD
SCHEMBL3710155 0.81 CDC7 (0.50) CDC7DBF4KDM4EALDH1A1HPGD
SCHEMBL3706009 0.80 CDC7 (0.51) CDC7DBF4KDM4EALDH1A1HPGD
SCHEMBL3705885 0.78 CDC7 (0.59) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL7893016 0.78 CDC7 (0.56) CDC7DBF4KDM4EALDH1A1HPGD

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