SCHEMBL7999780

SCHEMBL7999780

Cc1cc(C)c(S(=O)(=O)NC(=O)C(C#N)=C2NS(=O)(=O)c3ccccc32)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
HSD11B1 P28845 1/20 0.36
ALKBH3 Q96Q83 1/20 0.36
FTO Q9C0B1 1/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP13 P45452 1/20 0.35
CA12 O43570 1/20 0.35
USP2 O75604 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
SCHEMBL8019091 0.90 KDM4E (0.37) KDM4EALDH1A1HSD17B10LMNASMN1; SMN2
SCHEMBL7998848 0.88 HSD11B1 (0.38) KDM4EALDH1A1HSD17B10LMNAHSD11B1
SCHEMBL8007957 0.85 ALDH1A1 (0.41) KDM4EALDH1A1HSD17B10LMNAHSD11B1
SCHEMBL2744207 0.82 HSD11B1 (0.43) KDM4EALDH1A1HSD17B10LMNAHSD11B1
SCHEMBL7998787 0.80 HSD11B1 (0.34) KDM4EALDH1A1HSD17B10LMNAHSD11B1
SCHEMBL8014575 0.80 HSD11B1 (0.38) KDM4EALDH1A1LMNAHSD11B1KMT2A
SCHEMBL8010715 0.79 CA12 (0.40) KDM4EALDH1A1LMNAHSD11B1KMT2A
SCHEMBL7998459 0.79 CA1 (0.38) KDM4EALDH1A1LMNAHSD11B1KMT2A
SCHEMBL8008055 0.79 FLT1 (0.41) HSD11B1KMT2AMEN1PTGESALPL
SCHEMBL8011292 0.79 KMT2A (0.41) KDM4EALDH1A1HSD17B10LMNASMN1; SMN2

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