SCHEMBL10544802

SCHEMBL10544802

COc1nc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2-c2cnn(C)c2)n1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
BRD4 O60885 4/20 0.38
TYK2 P29597 1/20 0.35
GAA P10253 1/20 0.35
PDK2 Q15119 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
SCHEMBL10383476 0.86 MAPT (0.50) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL10544656 0.86 GAA (0.50) MAPTBRD4GAA
SCHEMBL10550801 0.82 MAPT (0.41) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL10760165 0.80 ALDH1A1 (0.39) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL8162051 0.80 MAPT (0.53) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL19034718 0.80 FBP1 (0.48) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL2994281 0.79 KDM4E (0.47) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL10819030 0.79 ALDH1A1 (0.47) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL10565947 0.79 ALDH1A1 (0.47) MAPTKDM4ENPC1ALDH1A1GAA
SCHEMBL10759004 0.79 ALDH1A1 (0.40) MAPTKDM4ENPC1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0083975-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-11-19 EP claimed
EP-0083975-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-07-20 EP claimed
US-4810282-A 3-ORTHO-(ISOXAZOLYL,ISOTHIAZOLYL, PYRAZOLYL,THIADIAZOLYL, OXADIAZOLYL AND TRIAZOLYL BENZENESULFONUREYLENE-1,2,4-TRIAZOLES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-03-07 US disclosed
EP-0083975-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-11-19 EP disclosed
US-4695311-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-09-22 US disclosed
US-4606755-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-08-19 US disclosed
US-4511392-A N--/PYRIMIDIN-2-YLAMINOCARBENYL/-HETERO-SUBSTITUETED BENZENSESULFO E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-04-16 US disclosed
EP-0083975-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-07-20 EP disclosed