SCHEMBL6587153

SCHEMBL6587153

Cc1nn(C)cc1OC(=O)Cl

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
GAA P10253 2/20 0.36
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
LMNA P02545 3/20 0.35
MAPT P10636 2/20 0.35
KDM4C Q9H3R0 1/20 0.35
ATM Q13315 1/20 0.34
GLA P06280 1/20 0.33
KMT2A Q03164 1/20 0.33
NAMPT P43490 1/20 0.33

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
SCHEMBL27789299 0.83 RAB9A (0.39) POLBGAAALDH1A1SMN1; SMN2RAB9A
SCHEMBL2901127 0.83 RAB9A (0.40) POLBGAAALDH1A1SMN1; SMN2RAB9A
SCHEMBL5983299 0.80 GLA (0.33) POLBGAAGLAKMT2A
SCHEMBL3730626 0.80 GAA (0.48) POLBGAAALDH1A1SMN1; SMN2RAB9A
SCHEMBL5344440 0.76 GAA (0.33) POLBGAALMNAGLAKMT2A
SCHEMBL16105736 0.76 GAA (0.42) POLBGAARAB9ANPC1LMNA
SCHEMBL1135830 0.76 IRAK4 (0.33) GAAGLAKMT2A
SCHEMBL26357447 0.71
SCHEMBL976056 0.71 GAA (0.50) POLBGAAALDH1A1SMN1; SMN2RAB9A
SCHEMBL23723702 0.69 ALDH1A1 (0.37) POLBGAAALDH1A1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020119612-A1 PYRAZOLE AMIDE COMPOUND AND APPLICATION THEREOF AS HERBICIDE 沈阳中化农药化工研发有限公司 2020-06-18 WO disclosed
EP-2285779-B1 Method for manufacturing aryl carboxamides BASF SE (DE) 2013-03-27 EP disclosed
EP-1414803-A1 PYRAZOLYLCARBOXANILIDES AS FUNGICIDES Bayer CropScience AG (DE) 2004-05-06 EP disclosed
WO-2003010149-A1 PYRAZOLYLCARBOXANILIDES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2003-02-06 WO disclosed