SCHEMBL4380910

SCHEMBL4380910

O=C(O)Nc1nsc2cccc(Cl)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.43
MCL1 Q07820 1/20 0.43
OGG1 O15527 1/20 0.39
MAPT P10636 5/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
AURKA O14965 1/20 0.38
ROCK2 O75116 1/20 0.38
CSF1R P07333 1/20 0.38
FGFR1 P11362 1/20 0.38
FLT1 P17948 1/20 0.38
RPS6KB1 P23443 1/20 0.38
FLT4 P35916 1/20 0.38
KDR P35968 1/20 0.38
FLT3 P36888 1/20 0.38
RPS6KA3 P51812 1/20 0.38
ROCK1 Q13464 1/20 0.38
AURKB Q96GD4 1/20 0.38
PLK3 Q9H4B4 1/20 0.38

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
SCHEMBL14149334 0.85 KCNK3 (0.45) MAPTKMT2AALDH1A1MEN1HTT
SCHEMBL13615128 0.84 TYK2 (0.47) MAPK1MCL1OGG1MAPTALDH1A1
SCHEMBL11095814 0.84 ALDH1A1 (0.39) MAPK1MCL1OGG1MAPTKMT2A
SCHEMBL4387162 0.84 KDR (0.38) MAPK1MCL1OGG1MAPTKMT2A
SCHEMBL10167644 0.77 KMT2A (0.48) MAPK1MAPTKMT2AALDH1A1MEN1
SCHEMBL10167657 0.74 LMNA (0.51)
SCHEMBL10167653 0.73 TRPV1 (0.42)
SCHEMBL10167667 0.73 SMO (0.44)
SCHEMBL10167640 0.72 NPC1 (0.47) MAPTALDH1A1ROCK2CSF1RKDR
SCHEMBL3810911 0.72 PARP1 (0.39) MAPK1MCL1OGG1MAPTKMT2A

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
EP-2123159-A1 (1,2-Benzisothiazol-3-yl)(thio)carbamates and (1,2-Benzisothiazol-3-yl)(thio)oxamates and their oxidation forms as pesticides Bayer CropScience AG (DE) 2009-11-25 EP disclosed