SCHEMBL289229

SCHEMBL289229

CCOC(=O)c1sc(-c2ccc(-c3ccccc3)cc2)nc1C

nearest known ligand 0.94

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 6/20 0.73
DBF4 Q9UBU7 6/20 0.73
TRPM8 Q7Z2W7 5/20 0.73
LMNA P02545 1/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
ALDH1A1 P00352 4/20 0.62
KDM4E B2RXH2 1/20 0.62
HPGD P15428 3/20 0.61
NPC1 O15118 2/20 0.61
MAPT P10636 3/20 0.60
GAA P10253 1/20 0.60
RARA P10276 1/20 0.60
RARB P10826 1/20 0.60
RARG P13631 1/20 0.60
NPSR1 Q6W5P4 1/20 0.59
RAB9A P51151 1/20 0.59
HSD17B10 Q99714 1/20 0.56

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
SCHEMBL1316281 0.97 CDC7 (0.77) CDC7DBF4TRPM8LMNASMN1; SMN2
SCHEMBL290013 0.91 CDC7 (0.68) CDC7DBF4TRPM8LMNASMN1; SMN2
SCHEMBL2880861 0.90 CDC7 (0.67) CDC7DBF4TRPM8LMNASMN1; SMN2
SCHEMBL8867673 0.90 CDC7 (0.67) CDC7DBF4TRPM8LMNASMN1; SMN2
SCHEMBL892889 0.89 CDC7 (0.77) CDC7DBF4TRPM8LMNASMN1; SMN2
SCHEMBL289996 0.89 CDC7 (0.65) CDC7DBF4TRPM8LMNASMN1; SMN2
SCHEMBL8867028 0.88 CDC7 (0.71) CDC7DBF4TRPM8LMNASMN1; SMN2
SCHEMBL290384 0.87 CDC7 (0.75) CDC7DBF4TRPM8LMNAALDH1A1
SCHEMBL2823339 0.86 CDC7 (0.73) CDC7DBF4TRPM8LMNASMN1; SMN2
SCHEMBL2885887 0.86 TRPM8 (0.78) CDC7DBF4TRPM8LMNASMN1; SMN2

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