SCHEMBL9201862

SCHEMBL9201862

COC(=O)c1c(S(=O)(=O)NC(=O)Nc2nc(C)cc(C)n2)c(C)nn1C

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
MAPT P10636 3/20 0.40
ALOX15 P16050 1/20 0.39
HPGD P15428 2/20 0.38
ESR1 P03372 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HTT P42858 1/20 0.37
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
RXFP1 Q9HBX9 1/20 0.36
RECQL P46063 1/20 0.36
POLB P06746 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL11204912 0.93 KMT2A (0.41) GAAMAPTALOX15HPGDESR1
SCHEMBL11018406 0.88 GAA (0.39) GAAMAPTALOX15HPGDESR1
SCHEMBL9204321 0.87 GAA (0.41) GAAMAPTALOX15HPGDESR1
SCHEMBL9204315 0.87 GAA (0.41) GAAMAPTALOX15HPGDESR1
SCHEMBL11212146 0.86 GAA (0.36) GAAMAPTHPGDKDM4E
SCHEMBL9195314 0.84 GAA (0.34) GAAKDM4E
SCHEMBL9202018 0.82 GAA (0.48) GAAMAPTALOX15HPGDESR1
SCHEMBL10567289 0.80 ALDH1A1 (0.56) GAAMAPTALOX15HPGDHSD17B10
SCHEMBL9202334 0.79 GAA (0.48) GAAMAPTALOX15LMNASMN1; SMN2
SCHEMBL9199996 0.79 GAA (0.45) GAAMAPTALOX15HPGDESR1

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
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 disclosed
US-4954164-A Pyrazolesulfonylurea derivatives, preparation thereof, herbicide containing said derivative as active ingredient and herbicidal method by use thereof NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1990-09-04 US disclosed
EP-0087780-A2 Pyrazolesulfonylurea derivative, preparation thereof, herbicide containing said derivative as active ingredient and herbicidal method by use thereof NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1983-09-07 EP disclosed