SCHEMBL9195498

SCHEMBL9195498

COc1cc(C)nc(NC(=O)NS(=O)(=O)c2nn(C)cc2Cl)n1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.47
TSHR P16473 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CDK1 P06493 1/20 0.39
POLB P06746 1/20 0.38
CYP1A2 P05177 1/20 0.38
ALOX15 P16050 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HIF1A Q16665 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL9201574 0.94 GAA (0.54) GAACDK1POLBCYP1A2ALDH1A1
SCHEMBL9199194 0.88 GAA (0.47) GAATSHRSMN1; SMN2CDK1POLB
SCHEMBL9195520 0.81 GAA (0.54) GAASMN1; SMN2CDK1CYP1A2ALOX15
SCHEMBL8474705 0.80 GAA (0.53) GAATSHRSMN1; SMN2CDK1CYP1A2
SCHEMBL10998786 0.79 GAA (0.50) GAATSHRSMN1; SMN2CDK1ALOX15
SCHEMBL10474734 0.79 GAA (0.52) GAATSHRSMN1; SMN2CDK1CYP1A2
SCHEMBL10929693 0.78 GAA (0.49) GAASMN1; SMN2CDK1POLBCYP1A2
SCHEMBL10898222 0.78 GAA (0.53) GAATSHRSMN1; SMN2CDK1CYP1A2
SCHEMBL10673663 0.78 GAA (0.46) GAATSHRSMN1; SMN2CDK1POLB
SCHEMBL8358944 0.78 GAA (0.46) GAATSHRSMN1; SMN2CDK1POLB

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-0087780-B2 Pyrazolesulfonylurea derivative, preparation thereof, herbicide containing said derivative as active ingredient and herbicidal method by use thereof NISSAN CHEMICAL IND LTD (JP) 1995-02-15 EP claimed