SCHEMBL290254

SCHEMBL290254

CCOC(=O)c1sc(-c2cc(C)ccc2-c2ccccc2)nc1C

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 5/20 0.56
CDC7 O00311 4/20 0.56
DBF4 Q9UBU7 4/20 0.56
LMNA P02545 2/20 0.56
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 4/20 0.54
MAPT P10636 5/20 0.53
GAA P10253 2/20 0.53
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
HPGD P15428 2/20 0.51
NPSR1 Q6W5P4 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MEN1 O00255 1/20 0.47
CYP2C9 P11712 1/20 0.47

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
SCHEMBL289371 0.85 SMN1; SMN2 (0.67) LMNAKDM4EALDH1A1MAPTGAA
SCHEMBL1316281 0.84 CDC7 (0.77) TRPM8CDC7DBF4LMNAKDM4E
SCHEMBL6845464 0.82 CDC7 (0.56) TRPM8CDC7DBF4LMNAKDM4E
SCHEMBL12875919 0.82 CDC7 (0.66) TRPM8CDC7DBF4LMNAKDM4E
SCHEMBL289229 0.81 CDC7 (0.73) TRPM8CDC7DBF4LMNAKDM4E
SCHEMBL3370278 0.81 TRPM8 (0.58) TRPM8CDC7DBF4LMNAKDM4E
SCHEMBL892889 0.79 CDC7 (0.77) TRPM8CDC7DBF4LMNAKDM4E
SCHEMBL290013 0.78 CDC7 (0.68) TRPM8CDC7DBF4LMNAKDM4E
SCHEMBL289156 0.78 ALDH1A1 (0.65) TRPM8CDC7DBF4LMNAKDM4E
SCHEMBL299133 0.78 LMNA (0.63) TRPM8CDC7DBF4LMNAKDM4E

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