SCHEMBL8747734

SCHEMBL8747734

COC(=O)c1ccccc1CN(C)S(C)(=O)=O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
LMNA P02545 3/20 0.51
ALDH1A1 P00352 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.49
TSPO P30536 2/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA5A P35218 1/20 0.46
CA9 Q16790 1/20 0.46
HSD17B10 Q99714 2/20 0.45
TSHR P16473 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP1A2 P05177 1/20 0.45
HIF1A Q16665 1/20 0.44
CFTR P13569 1/20 0.44
POLB P06746 1/20 0.43
MEN1 O00255 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL27601009 0.87 KDM4E (0.44) KMT2ALMNAALDH1A1L3MBTL1TSPO
SCHEMBL3437042 0.83 KDM4E (0.48) KMT2AALDH1A1CA1CA2CA9
SCHEMBL8747754 0.81 KMT2A (0.43) KMT2AALDH1A1L3MBTL1HSD17B10KDM4E
SCHEMBL8748143 0.81 POLB (0.50) KMT2AALDH1A1HSD17B10TSHRKDM4E
SCHEMBL8747769 0.81 KMT2A (0.43) KMT2ALMNAALDH1A1L3MBTL1HSD17B10
SCHEMBL8747756 0.78 CFTR (0.53) KMT2ALMNAALDH1A1HSD17B10KDM4E
SCHEMBL15461583 0.78 ALDH1A1 (0.57) KMT2ALMNAALDH1A1L3MBTL1CA1
SCHEMBL646787 0.77 L3MBTL1 (0.54) KMT2ALMNAALDH1A1L3MBTL1TSPO
SCHEMBL8754736 0.75 KDM4E (0.40) KMT2ALMNAALDH1A1L3MBTL1HSD17B10
SCHEMBL6184555 0.75 ALDH1A1 (0.54) KMT2ALMNAALDH1A1L3MBTL1CA1

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
CN-1148385-A 4-benzoylisoxazole derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1997-04-23 CN disclosed
EP-0759911-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1997-03-05 EP disclosed
WO-1995031446-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1995-11-23 WO disclosed