SCHEMBL26501949

SCHEMBL26501949

CCNS(=O)(=O)c1c(F)cc(F)c(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.42
CA2 P00918 7/20 0.42
CA9 Q16790 2/20 0.42
CA12 O43570 1/20 0.39
CA7 P43166 1/20 0.39
CA13 Q8N1Q1 1/20 0.39
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TP53 P04637 1/20 0.36
PKM P14618 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C9 P11712 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
GLA P06280 1/20 0.34
VCAM1 P19320 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33

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
SCHEMBL26075285 0.89 CA1 (0.51) CA1CA2CA9CA12CA7
SCHEMBL26075166 0.86 CA1 (0.44) CA1CA2CA9CA12CA7
SCHEMBL26075366 0.80 CA1 (0.50) CA1CA2CA12CA7CA13
SCHEMBL26075284 0.79 ALDH1A1 (0.44) CA1CA2CA9ALDH1A1SMN1; SMN2
SCHEMBL26075094 0.78 CA1 (0.39) CA1CA2CA9CA12CA7
SCHEMBL14324823 0.74 ALOX5AP (0.41) CA1CA2CA9CA12CA7
SCHEMBL25359552 0.73 CA2 (0.38) CA1CA2CA9CA12ALDH1A1
SCHEMBL20237716 0.71 CA1 (0.48) CA1CA2CA9CA12CA7
SCHEMBL29505942 0.71 CA1 (0.48) CA1CA2CA9CA12CA7
SCHEMBL15453138 0.69 CA1 (0.49) CA1CA2CA9CA12CA7

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
WO-2023192817-A1 INHIBITORS OF THE MYST FAMILY OF LYSINE ACETYL TRANSFERASES Isosterix, Inc. (US) 2023-10-05 WO disclosed