SCHEMBL7998311

SCHEMBL7998311

Cc1nsc(NC(=O)Cc2ccc(N)cc2)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GLS O94925 3/20 0.44
MAPK8 P45983 5/20 0.43
FFAR2 O15552 1/20 0.41
POLB P06746 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 4/20 0.40
NPC1 O15118 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 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
SCHEMBL7994626 0.96 GLS (0.42) GLSMAPK8FFAR2POLBKDM4E
SCHEMBL8094492 0.93 MAPK8 (0.41) GLSMAPK8KDM4EALDH1A1GAA
SCHEMBL7232438 0.88 GLS (0.43) GLSMAPK8FFAR2POLBKDM4E
SCHEMBL7735892 0.86 RAB9A (0.46) MAPK8FFAR2POLBKDM4EALDH1A1
SCHEMBL7233873 0.85 MAPK8 (0.54) GLSMAPK8KDM4EALDH1A1GAA
SCHEMBL7230936 0.84 GAA (0.47) MAPK8ALDH1A1GAAL3MBTL1
SCHEMBL8094494 0.83 MAPK8 (0.44) GLSMAPK8ALDH1A1RAB9AMAPT
SCHEMBL7997967 0.80 KDM4E (0.41) KDM4EALDH1A1GAARAB9ANPC1
SCHEMBL8069562 0.78 MAPK8 (0.47) GLSMAPK8POLBKDM4ERAB9A
SCHEMBL7998415 0.77 KDM4E (0.39) KDM4EALDH1A1GAARAB9ANPC1

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-2001055140-A1 ISOTHIAZOLE DERIVATIVES AND THEIR USE AS PESTICIDES SYNGENTA LIMITED (GB) 2001-08-02 WO disclosed