SCHEMBL10384286

SCHEMBL10384286

COc1nc(NC(=O)NS(=O)(=O)c2ccccc2OC(F)(F)C(F)(F)F)nc(OC)n1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
NPC1 O15118 1/20 0.44
GAA P10253 1/20 0.43
ABCC9 O60706 1/20 0.37
ABCC8 Q09428 1/20 0.37
KCNJ11 Q14654 1/20 0.37
KCNJ8 Q15842 1/20 0.37
MAPK1 P28482 1/20 0.36
CDK1 P06493 1/20 0.36
PDK1 Q15118 1/20 0.36
PDK2 Q15119 1/20 0.36
PDK3 Q15120 1/20 0.36
PDK4 Q16654 1/20 0.36
ALPL P05186 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
SCHEMBL10915190 0.94 MAPT (0.42) MAPTKDM4EALDH1A1NPC1GAA
SCHEMBL10695682 0.91 MAPT (0.46) MAPTKDM4EALDH1A1NPC1GAA
SCHEMBL10383235 0.88 GAA (0.58) MAPTKDM4EALDH1A1NPC1GAA
SCHEMBL10913796 0.86 ALDH1A1 (0.46) MAPTKDM4EALDH1A1NPC1GAA
SCHEMBL10692208 0.85 MAPT (0.43) MAPTKDM4EALDH1A1NPC1GAA
SCHEMBL10916479 0.85 GAA (0.52) MAPTALDH1A1GAACDK1SMN1; SMN2
SCHEMBL7805854 0.84 MAPT (0.42) MAPTKDM4EALDH1A1NPC1GAA
SCHEMBL11000660 0.83 MAPT (0.42) MAPTKDM4EALDH1A1NPC1GAA
SCHEMBL11175919 0.83 MAPT (0.46) MAPTKDM4EALDH1A1NPC1GAA
SCHEMBL10889026 0.82 ALDH1A1 (0.50) MAPTKDM4EALDH1A1NPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0122231-B1 HERBICIDAL AGENT CIBA-GEIGY AG (CH) 1990-01-17 EP claimed
EP-0044808-B1 N-PHENYLSULFONYL-N'-PYRIMIDINYL- AND -TRIAZINYL UREAS CIBA-GEIGY AG (CH) 1986-01-15 EP claimed
US-4537619-A HERBICIDES AND PLANT GROWTH REGULATORS CIBA GEIGY CORPORATION (US) 1985-08-27 US claimed
US-4911751-A Using a sulfonylurea heterocyclic compound CIBA-GEIGY CORPORATION (US) 1990-03-27 US disclosed
US-4537619-A HERBICIDES AND PLANT GROWTH REGULATORS CIBA GEIGY CORPORATION (US) 1985-08-27 US disclosed