SCHEMBL3708563

SCHEMBL3708563

CCOC(=O)c1sc(-c2cc(C)c3[nH]cc(/C=N/O)c3c2)nc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 5/20 0.47
DBF4 Q9UBU7 5/20 0.47
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.41
LMNA P02545 1/20 0.41
TRPM8 Q7Z2W7 4/20 0.40
ATM Q13315 2/20 0.38
POLB P06746 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
MAPT P10636 4/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
APOBEC3G Q9HC16 1/20 0.38

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
SCHEMBL3708564 1.00 CDC7 (0.47) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3712083 0.89 CDC7 (0.50) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3716327 0.85 CDC7 (0.50) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3716332 0.85 CDC7 (0.50) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3716328 0.85 CDC7 (0.50) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3708562 0.81 CDC7 (0.50) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3710935 0.80 CDC7 (0.49) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3705237 0.80 CDC7 (0.48) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3707390 0.75 CDC7 (0.58) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL3704315 0.73 CDC7 (0.53) CDC7DBF4KDM4EALDH1A1LMNA

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