SCHEMBL8539797

SCHEMBL8539797

COc1nc(C)nc(NC(=O)NS(=O)(=O)Nc2ccccc2C#CC(C)OC)n1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.35
SLC16A3 O15427 7/20 0.33
TP53 P04637 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL8536574 0.88 ALOX15 (0.38) ALOX15SLC16A3TP53GAA
SCHEMBL8534921 0.88 ALOX15 (0.40) ALOX15SLC16A3TP53GAA
SCHEMBL8541132 0.87 GAA (0.44) ALOX15SLC16A3TP53GAA
SCHEMBL8538403 0.87 ALOX15 (0.37) ALOX15SLC16A3TP53GAA
SCHEMBL8539805 0.86 ALOX15 (0.37) ALOX15SLC16A3TP53GAA
SCHEMBL8536335 0.84 ALOX15 (0.39) ALOX15TP53GAA
SCHEMBL8539853 0.84 ALOX15 (0.36) ALOX15SLC16A3TP53GAA
SCHEMBL8535082 0.84 ALOX15 (0.36) ALOX15SLC16A3TP53GAA
SCHEMBL8540370 0.83 ALOX15 (0.35) ALOX15SLC16A3TP53GAA
SCHEMBL8540134 0.82 TP53 (0.35) ALOX15SLC16A3TP53GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0770603-B1 Alkynylphenylaminosulfonyl ureas as herbicides ISAGRO RICERCA SRL (IT) 1998-09-16 EP disclosed
EP-0770603-A1 Alkynylphenylaminosulfonyl ureas as herbicides ISAGRO RICERCA S.r.l. (IT) 1997-05-02 EP disclosed