SCHEMBL290243

SCHEMBL290243

CCOC(=O)c1sc(-c2ccsc2)nc1C

nearest known ligand 0.79

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 11/20 0.79
DBF4 Q9UBU7 11/20 0.79
KDM4E B2RXH2 2/20 0.61
ALDH1A1 P00352 1/20 0.61
LMNA P02545 1/20 0.56
TRPM8 Q7Z2W7 4/20 0.53
MAPT P10636 2/20 0.51
MEN1 O00255 1/20 0.48
HSP90AA1 P07900 1/20 0.48
CRHBP P24387 1/20 0.48
KMT2A Q03164 1/20 0.48
CRHR2 Q13324 1/20 0.48
CHEK2 O96017 1/20 0.48

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
SCHEMBL289549 0.89 CDC7 (0.63) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL5733147 0.83 CDC7 (1.00) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL1316281 0.82 CDC7 (0.77) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL892889 0.82 CDC7 (0.77) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL12034449 0.81 CDC7 (0.69) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL290384 0.81 CDC7 (0.75) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL2885887 0.80 TRPM8 (0.78) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL4464882 0.80 CDC7 (0.73) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL2823339 0.80 CDC7 (0.73) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL2085303 0.80 CDC7 (0.73) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427447-A2 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION Pike Pharma GmbH (CH) 2012-03-14 EP disclosed
WO-2010128163-A2 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION PIKE PHARMA GMBH (CH) 2010-11-11 WO disclosed