SCHEMBL8019091

SCHEMBL8019091

Cc1cc(C)c(C)c(S(=O)(=O)NC(=O)C(C#N)=C2NS(=O)(=O)c3ccccc32)c1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.37
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 3/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
HPGD P15428 2/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
HSD11B1 P28845 1/20 0.36
LMNA P02545 2/20 0.35
CA12 O43570 1/20 0.35
USP2 O75604 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
BCHE P06276 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 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
SCHEMBL7998848 0.93 HSD11B1 (0.38) KDM4EALDH1A1HSD17B10KMT2AMEN1
SCHEMBL7999780 0.90 KDM4E (0.39) KDM4EALDH1A1HSD17B10KMT2AMEN1
SCHEMBL8007957 0.83 ALDH1A1 (0.41) KDM4EALDH1A1HSD17B10KMT2AHSD11B1
SCHEMBL2744207 0.82 HSD11B1 (0.43) KDM4EALDH1A1HSD17B10KMT2AHPGD
SCHEMBL8014575 0.80 HSD11B1 (0.38) KDM4EALDH1A1KMT2AMEN1HSD11B1
SCHEMBL8010715 0.79 CA12 (0.40) KDM4EALDH1A1KMT2AMEN1HPGD
SCHEMBL8008055 0.79 FLT1 (0.41) KMT2AMEN1HSD11B1PTGESPTGS2
SCHEMBL8011292 0.79 KMT2A (0.41) KDM4EALDH1A1HSD17B10KMT2AMEN1
SCHEMBL7998459 0.79 CA1 (0.38) KDM4EALDH1A1KMT2AHSD11B1LMNA
SCHEMBL8008194 0.78 FBP1 (0.41) KDM4EHSD17B10KMT2AMEN1PTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6165668-A N-[2-(1,2-benzisothiazol-3(2H)-ylidene 1,1-dioxide)-2-cyanoacetyl]benzenesulfonamide charge control agents for electrostatographic toners and developers EASTMAN KODAK COMPANY (US) 2000-12-26 US disclosed