SCHEMBL14397244

SCHEMBL14397244

CC(F)Oc1cccc2c1C(=N)NS2(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.36
GRK5 P34947 1/20 0.36
TYRO3 Q06418 1/20 0.36
DYRK1B Q9Y463 1/20 0.36
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA4 P22748 2/20 0.31
CA7 P43166 2/20 0.31
CA9 Q16790 2/20 0.31
ALPL P05186 1/20 0.30
ALPI P09923 1/20 0.30

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
SCHEMBL14397035 0.77 RET (0.36) RETGRK5TYRO3DYRK1BCA12
SCHEMBL12292070 0.77 RET (0.37) RETGRK5TYRO3DYRK1BCA12
SCHEMBL14397240 0.76 ELANE (0.35) CA2CA9
SCHEMBL14397242 0.75 RET (0.37) RETGRK5TYRO3DYRK1BCA12
SCHEMBL12292065 0.74 RET (0.39) RETGRK5TYRO3DYRK1BCA12
SCHEMBL14397241 0.73 ELANE (0.40) CA12CA9
SCHEMBL645346 0.72 RET (0.53) RETGRK5TYRO3DYRK1BCA12
SCHEMBL12292104 0.68 RET (0.40) RETGRK5TYRO3DYRK1BCA12
SCHEMBL2936736 0.68 KMT2A (0.42) CA12CA1CA2CA4CA7
SCHEMBL14397234 0.68 LMNA (0.33)

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-2007113119-A1 3-AMINO-1,2-BENZISOTHIAZOLE COMPOUNDS FOR COMBATING ANIMAL PEST BASF SE (DE) 2007-10-11 WO disclosed