SCHEMBL10929693

SCHEMBL10929693

CCOC(=O)c1cn(C)nc1S(=O)(=O)NC(=O)Nc1nc(OC)cc(OC)n1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
CDK1 P06493 1/20 0.42
MAPT P10636 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.39
TP53 P04637 1/20 0.38
GLA P06280 1/20 0.38
LMNA P02545 1/20 0.37
ADORA2A P29274 3/20 0.37
ADORA1 P30542 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL8474705 0.87 GAA (0.53) GAACDK1MAPTALDH1A1CYP1A2
SCHEMBL9201574 0.82 GAA (0.54) GAACDK1MAPTALDH1A1KDM4E
SCHEMBL9195520 0.82 GAA (0.54) GAACDK1MAPTALDH1A1CYP1A2
SCHEMBL10524219 0.82 GAA (0.42) GAACDK1MAPTALDH1A1KDM4E
Pyrazosulfuron Ethyl SCHEMBL22006 0.81 GAA (0.48) GAACDK1MAPTALDH1A1KDM4E
SCHEMBL8505322 0.80 GAA (0.50) GAACDK1MAPTALDH1A1KDM4E
Pyrazosulfuron Ethyl SCHEMBL15513045 0.80 GAA (0.47) GAACDK1MAPTALDH1A1KDM4E
Pyrazosulfuron Ethyl SCHEMBL15524983 0.80 GAA (0.47) GAACDK1MAPTALDH1A1KDM4E
SCHEMBL9199246 0.80 GAA (0.49) GAACDK1MAPTALDH1A1KDM4E
SCHEMBL8358912 0.78 ADORA2A (0.47) MAPTALDH1A1KDM4ECYP1A2POLB

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
JP-59199686-A None JP disclosed
JP-60045574-A None JP disclosed
JP-S6045574-A PYRAZOLESULFONYLUREA DERIVATIVE, ITS PREPARATION AND HERBICIDE CONTAINING SAID DERIVATIVE NISSAN CHEM IND LTD 1985-03-12 JP disclosed
JP-S59199686-A PYRAZOLESULFONYLUREA DERIVATIVE, ITS PREPARATION AND HERBICIDE CONTAINING THE SAME NISSAN CHEM IND LTD 1984-11-12 JP disclosed