SCHEMBL11040663

SCHEMBL11040663

O=C(CSc1nc(-c2cccnc2)c(-c2ccccc2)s1)CSc1nc(-c2cccnc2)c(-c2ccccc2)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PKM P14618 1/20 0.47
POLB P06746 2/20 0.46
APEX1 P27695 1/20 0.46
RECQL P46063 1/20 0.46
ALOX5 P09917 1/20 0.45
HRH3 Q9Y5N1 1/20 0.43
ALDH1A1 P00352 5/20 0.42
THRB P10828 2/20 0.42
KDM4E B2RXH2 3/20 0.41
PTPN1 P18031 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
CDC7 O00311 1/20 0.41
DBF4 Q9UBU7 1/20 0.41
MAPT P10636 5/20 0.41
PTGS2 P35354 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL11043360 0.85 MAPK1 (0.52) MEN1KMT2APKMALOX5HRH3
SCHEMBL7649606 0.83 HRH3 (0.45) KMT2AALOX5HRH3ALDH1A1KDM4E
SCHEMBL11040063 0.82 ALOX5 (0.45) MEN1KMT2APKMAPEX1ALOX5
SCHEMBL11040676 0.81 ALOX5 (0.50) MEN1KMT2AALOX5HRH3ALDH1A1
SCHEMBL11042391 0.80 PTGS2 (0.54) MEN1KMT2APOLBAPEX1RECQL
SCHEMBL11040740 0.80 MAPK1 (0.52) MEN1KMT2APKMPOLBALOX5
SCHEMBL7621307 0.79 ALOX5 (0.48) ALOX5HRH3ALDH1A1KDM4EMAPT
SCHEMBL11041661 0.78 HRH3 (0.45) KMT2AALOX5HRH3ALDH1A1KDM4E
SCHEMBL11750819 0.78 GAA (0.52) MEN1KMT2APKMPOLBAPEX1
SCHEMBL11753338 0.74 PTGS2 (0.48) MEN1KMT2APKMPOLBHRH3

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
US-4451471-A Certain 2,4,5-tri-substituted thiazoles, pharmaceutical compositions containing same and methods of using same CIBA-GEIGY CORPORATION (US) 1984-05-29 US disclosed
EP-0061425-A2 Thiazole derivatives, processes for their preparation, medicaments containing them and their use CIBA-GEIGY AG (CH) 1982-09-29 EP disclosed