SCHEMBL6204792

SCHEMBL6204792

COc1cc(O)cc(-c2nc3ccccc3s2)c1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.81
KDM4E B2RXH2 7/20 0.81
ALDH1A1 P00352 6/20 0.81
MEN1 O00255 4/20 0.81
KMT2A Q03164 4/20 0.81
HPGD P15428 3/20 0.81
TDP1 Q9NUW8 2/20 0.81
L3MBTL1 Q9Y468 1/20 0.81
MAPT P10636 9/20 0.68
RAB9A P51151 7/20 0.68
NFKB1 P19838 2/20 0.68
NFKB2 Q00653 2/20 0.68
RELA Q04206 2/20 0.68
NPC1 O15118 5/20 0.65
PKM P14618 1/20 0.65
TP53 P04637 2/20 0.61
HSD17B10 Q99714 2/20 0.61
LMNA P02545 2/20 0.61
POLB P06746 1/20 0.61
GLA P06280 3/20 0.60

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
SCHEMBL12471067 0.85 RAB9A (0.76) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL25713615 0.85 RAB9A (0.76) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL30161523 0.81 MAPT (1.00) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL2090795 0.81 MAPT (1.00) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL27604182 0.81 KDM4E (0.60) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL5831730 0.80 KDM4E (0.75) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL2242816 0.79 KDM4E (1.00) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL5981201 0.79 MAPT (0.71) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL24140789 0.78 KDM4E (0.76) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A
SCHEMBL13053014 0.77 RAB9A (0.69) SMN1; SMN2KDM4EALDH1A1MEN1KMT2A

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
EP-1539723-A1 NOVEL USE OF BENZOTHIAZOLE DERIVATIVES AstraZeneca AB (SE) 2005-06-15 EP claimed
WO-2004016600-A1 NOVEL USE OF BENZOTHIAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2004-02-26 WO claimed
EP-1539723-A1 NOVEL USE OF BENZOTHIAZOLE DERIVATIVES AstraZeneca AB (SE) 2005-06-15 EP disclosed
WO-2004016600-A1 NOVEL USE OF BENZOTHIAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2004-02-26 WO disclosed