SCHEMBL7801293

SCHEMBL7801293

COc1cc(OC)nc(NC(=O)NS(=O)(=O)Nc2ccccc2C(=O)NC2CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 2/20 0.48
GAA P10253 1/20 0.45
PKM P14618 1/20 0.43
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.41
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL53468 0.87 GAA (0.47) GAATP53GLAMAPTKMT2A
SCHEMBL29510603 0.87 GAA (0.47) GAATP53GLAMAPTKMT2A
SCHEMBL7813210 0.87 GAA (0.49) PTK2GAATP53GLAMAPT
SCHEMBL6812884 0.86 GAA (0.47) GAATP53GLAMAPTKMT2A
SCHEMBL7808110 0.86 GAA (0.48) GAATP53GLAMAPTKMT2A
SCHEMBL8380205 0.84 GAA (0.51) GAATP53GLAMAPTKMT2A
SCHEMBL8535695 0.84 GAA (0.51) GAATP53GLAMAPTKMT2A
SCHEMBL7808045 0.84 GAA (0.47) PTK2GAATP53GLAMAPT
SCHEMBL7808085 0.83 GAA (0.50) GAAPKMTP53GLAMAPT
SCHEMBL3207655 0.82 GAA (0.45) PTK2GAATP53MAPTL3MBTL1

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
EP-0971902-B1 AMINOSULFONYLUREAS WITH HERBICIDAL ACTIVITY ISAGRO RICERCA SRL (IT) 2001-12-19 EP disclosed
US-6329323-B1 AMINOTRIAZINE DERIVATIVES ISAGRO RICERCA S.R.L. (IT) 2001-12-11 US disclosed
EP-0971902-A1 AMINOSULFONYLUREAS WITH HERBICIDAL ACTIVITY ISAGRO RICERCA S.r.l. (IT) 2000-01-19 EP disclosed
WO-1998040361-A1 AMINOSULFONYLUREAS WITH HERBICIDAL ACTIVITY ISAGRO RICERCA S.R.L. (IT) 1998-09-17 WO disclosed