SCHEMBL7059356

SCHEMBL7059356

NNC(=O)Oc1cccc2nnsc12

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 8/20 0.35
NPC1 O15118 4/20 0.35
TP53 P04637 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
RAB9A P51151 3/20 0.35
THRB P10828 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 3/20 0.32
PGR P06401 1/20 0.32
PTGS1 P23219 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MALT1 Q9UDY8 1/20 0.32
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL7059454 0.83 MEN1 (0.38) KDM4EMAPTNPC1TP53SMN1; SMN2
SCHEMBL9366943 0.83 MAPT (0.39) KDM4EMAPTNPC1TP53SMN1; SMN2
SCHEMBL9522187 0.81 KDM4E (0.44) KDM4EMAPTNPC1TP53SMN1; SMN2
SCHEMBL8057087 0.80 MAPT (0.38) KDM4EMAPTNPC1TP53SMN1; SMN2
SCHEMBL9381252 0.79 MAPT (0.34) GAAKDM4EMAPTNPC1TP53
SCHEMBL9521846 0.78 MAPT (0.37) MAPTNPC1TP53SMN1; SMN2RAB9A
SCHEMBL9521705 0.78 PTGS2 (0.41) GAAKDM4EMAPTSMN1; SMN2MEN1
SCHEMBL7603698 0.78 MAPT (0.39) KDM4EMAPTNPC1TP53SMN1; SMN2
SCHEMBL9363731 0.77 MAPT (0.32) MAPT
SCHEMBL7919531 0.76 MAPT (0.33) MAPTNPC1TP53SMN1; SMN2RAB9A

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
WO-2003033712-A1 CHEMICALLY INDUCIBLE PROMOTERS FROM BARLEY AND USE THEREOF BASF PLANT SCIENCE GMBH (DE) 2003-04-24 WO disclosed
EP-0313512-B1 BENZOTHIADIAZOLES AND THEIR USE IN PROCESSES AND COMPOSITIONS AGAINST PLANT DISEASES CIBA-GEIGY AG (CH) 1992-11-25 EP disclosed
EP-0313512-A2 Benzothiadiazoles and their use in processes and compositions against plant diseases CIBA-GEIGY AG (CH) 1989-04-26 EP disclosed