SCHEMBL290132

SCHEMBL290132

CCOC(=O)c1sc(-c2cccs2)nc1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 1.00
ALDH1A1 P00352 4/20 1.00
GAA P10253 3/20 0.66
CDC7 O00311 6/20 0.64
DBF4 Q9UBU7 6/20 0.64
LMNA P02545 1/20 0.60
HPGD P15428 3/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
MAPT P10636 2/20 0.51
TRPM8 Q7Z2W7 1/20 0.50
KMT2A Q03164 1/20 0.50
CASP1 P29466 1/20 0.49
HTT P42858 1/20 0.48
KEAP1 Q14145 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
SCHEMBL289139 0.92 KDM4E (0.86) KDM4EALDH1A1GAACDC7DBF4
SCHEMBL288534 0.92 KDM4E (0.86) KDM4EALDH1A1GAACDC7DBF4
SCHEMBL290099 0.90 KDM4E (0.81) KDM4EALDH1A1GAACDC7DBF4
SCHEMBL288994 0.89 KDM4E (0.80) KDM4EALDH1A1GAACDC7DBF4
SCHEMBL289613 0.88 KDM4E (0.78) KDM4EALDH1A1GAACDC7DBF4
SCHEMBL290007 0.87 KDM4E (0.76) KDM4EALDH1A1GAACDC7DBF4
SCHEMBL290249 0.87 KDM4E (0.76) KDM4EALDH1A1GAACDC7DBF4
SCHEMBL289644 0.86 KDM4E (0.74) KDM4EALDH1A1GAACDC7DBF4
SCHEMBL299676 0.84 KDM4E (0.72) KDM4EALDH1A1GAACDC7DBF4
SCHEMBL289916 0.83 KDM4E (0.71) KDM4EALDH1A1GAACDC7DBF4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107151243-B 2-substituted-4-methyl-5- (4, 5-dihydrothiazole-2-yl) -1, 3-thiazole compounds, preparation method and biological activity evaluation thereof 江苏海洋大学 2020-09-08 CN disclosed
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
CN-1242994-C Novel heterocyclic compound and medicinal use thereof KYOTO PHARMA IND (JP) 2006-02-22 CN disclosed