SCHEMBL11499488

SCHEMBL11499488

CCCCCN1C(=O)NCNC1=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.50
FAAH O00519 4/20 0.50
PTGS1 P23219 3/20 0.50
PTGS2 P35354 3/20 0.50
CYP19A1 P11511 3/20 0.41
ALOX5 P09917 2/20 0.41
ALDH1A1 P00352 2/20 0.40
ALDH2 P05091 1/20 0.40
ALDH3A1 P30838 1/20 0.40
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
CNR2 P34972 2/20 0.39
CES1 P23141 1/20 0.39
CDC25A P30304 1/20 0.39

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
SCHEMBL2991298 0.79 MGLL (0.47) MGLLFAAHPTGS1PTGS2CYP19A1
SCHEMBL9805882 0.78 MGLL (0.50) MGLLFAAHPTGS1PTGS2CYP19A1
SCHEMBL9805872 0.78 MGLL (0.50) MGLLFAAHPTGS1PTGS2CYP19A1
SCHEMBL9805866 0.78 MGLL (0.50) MGLLFAAHPTGS1PTGS2CYP19A1
SCHEMBL9805873 0.78 MGLL (0.50) MGLLFAAHPTGS1PTGS2CYP19A1
SCHEMBL9805920 0.78 MGLL (0.50) MGLLFAAHPTGS1PTGS2CYP19A1
SCHEMBL9805915 0.78 MGLL (0.50) MGLLFAAHPTGS1PTGS2CYP19A1
SCHEMBL9805904 0.78 MGLL (0.50) MGLLFAAHPTGS1PTGS2CYP19A1
SCHEMBL9805934 0.78 MGLL (0.50) MGLLFAAHPTGS1PTGS2CYP19A1
SCHEMBL10473661 0.76 MGLL (0.50) MGLLFAAHPTGS1PTGS2CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0011693-A1 N-trifluoromethane-sulfonylaminophenyl-substituted N-heterocycles, their preparation, compositions containing them and their use in regulating plant growth CIBA-GEIGY AG (CH) 1980-06-11 EP disclosed