SCHEMBL289730

SCHEMBL289730

CCOC(=O)c1sc(-c2ccc(-c3ccncc3)s2)nc1C

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 16/20 0.79
DBF4 Q9UBU7 16/20 0.79
KDM4E B2RXH2 2/20 0.64
ALDH1A1 P00352 1/20 0.64
LMNA P02545 1/20 0.56
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
Hydrochloric Acid SCHEMBL289729 0.99 CDC7 (0.77) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL290675 0.89 KDM4E (0.62) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL289156 0.89 ALDH1A1 (0.65) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL5733147 0.88 CDC7 (1.00) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL290101 0.88 ALDH1A1 (0.64) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL289784 0.87 CDC7 (0.62) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL289506 0.86 CDC7 (0.62) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL290306 0.86 ALDH1A1 (0.59) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL289746 0.86 TRPM8 (0.62) CDC7DBF4KDM4EALDH1A1LMNA
SCHEMBL289583 0.86 KDM4E (0.65) 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