SCHEMBL7995986

SCHEMBL7995986

Cc1nsc(NC(=O)COc2ccc3oc(CC(C)(C)C)nc3c2)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.43
KDM4E B2RXH2 3/20 0.43
HPGD P15428 3/20 0.43
PPARG P37231 1/20 0.43
NCOA2 Q15596 1/20 0.43
NCOA1 Q15788 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
CETP P11597 7/20 0.42
RXFP1 Q9HBX9 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
ANO1 Q5XXA6 1/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NR2E3 Q9Y5X4 1/20 0.40
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL5735113 0.84 GAA (0.43) MAPTKDM4EHPGDPPARGRXFP1
SCHEMBL7995977 0.83 ACLY (0.39) MAPTRXFP1SMN1; SMN2TP53
SCHEMBL6790398 0.81 GAA (0.50) MAPTKDM4ERXFP1TP53
SCHEMBL1599472 0.80 ACLY (0.40) MAPTSMN1; SMN2
SCHEMBL5735580 0.79 ACLY (0.39) MAPTHPGDSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL5736818 0.79 ACLY (0.39) KDM4EPPARGCETP
SCHEMBL6790401 0.78 ACLY (0.39) MAPTSMN1; SMN2TP53
SCHEMBL7994515 0.78 ACLY (0.41) MAPTKDM4ESMN1; SMN2ALDH1A1TP53
SCHEMBL7993931 0.78 GAA (0.41) MAPTKDM4EHPGDPPARGRXFP1
SCHEMBL8001808 0.77 GAA (0.42) MAPTRXFP1TP53THRB

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-2001055139-A1 ISOTHIAZOLE DERIVATIVES AND THEIR USE AS PESTICIDES SYNGENTA LIMITED (GB) 2001-08-02 WO disclosed