SCHEMBL8568807

SCHEMBL8568807

O=C(O)Cc1nsc(NC(=O)Oc2ccc([N+](=O)[O-])cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.44
GAA P10253 4/20 0.41
BCL9 O00512 1/20 0.40
CTNNB1 P35222 1/20 0.40
MAPT P10636 5/20 0.39
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
THRB P10828 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MYOC Q99972 1/20 0.38
ATM Q13315 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL8574324 0.85 MGLL (0.43) MGLLGAABCL9CTNNB1MAPT
SCHEMBL8572623 0.84 ALDH1A1 (0.48) GAAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL20971726 0.81 MGLL (0.47) MGLLGAABCL9CTNNB1MAPT
SCHEMBL29708145 0.79 GAA (0.50) MGLLGAABCL9CTNNB1MAPT
SCHEMBL8565123 0.74 ALDH1A1 (0.49) MAPTRAB9ANPC1LMNASMN1; SMN2
SCHEMBL8569581 0.73 ALDH1A1 (0.44) MAPTRAB9ANPC1LMNASMN1; SMN2
SCHEMBL15077546 0.72 RAB9A (0.55) GAAMAPTRAB9ANPC1LMNA
SCHEMBL538117 0.71 MAPT (0.59) MGLLGAAMAPTRAB9ANPC1
SCHEMBL3062188 0.71 LMNA (0.66) GAAMAPTRAB9ANPC1LMNA
SCHEMBL1912722 0.70 MAPT (0.53) MGLLGAABCL9CTNNB1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5705650-A Process for preparing 1,2,4-thiadiazole derivatives KATAYAMA SEIYAKUSYO CO., LTD. (JP) 1998-01-06 US disclosed
US-5585494-A Process for preparing 1,2,4-thiadiazole derivatives KATAYAMA SEIYAKUSYO CO. LTD. (JP) 1996-12-17 US disclosed
EP-0536900-A2 Process for preparing 1,2,4-Thiadiazole Derivatives KATAYAMA SEIYAKUSYO CO. Ltd. (JP) 1993-04-14 EP disclosed