SCHEMBL2359299

SCHEMBL2359299

O=C1c2ccccc2C(=S)N1CCl

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 2/20 0.46
CA12 O43570 2/20 0.46
CA9 Q16790 2/20 0.46
GLS O94925 1/20 0.46
DPP4 P27487 1/20 0.44
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
APAF1 O14727 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
DRD3 P35462 1/20 0.41
ELANE P08246 1/20 0.41

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
SCHEMBL31402 0.85 CA12 (0.54) CASP3CA12CA9GLSALDH1A1
SCHEMBL1330864 0.85 CA12 (0.54) CASP3CA12CA9GLSALDH1A1
SCHEMBL31643071 0.85 CA12 (0.54) CASP3CA12CA9GLSALDH1A1
SCHEMBL11608773 0.85 GLS (0.47) CASP3CA12CA9GLSALDH1A1
SCHEMBL11845945 0.83 GLS (0.53) CASP3CA12CA9GLSALDH1A1
SCHEMBL11843816 0.83 CA12 (0.48) CASP3CA12CA9GLSALDH1A1
SCHEMBL11083983 0.81 CASP3 (0.66) CASP3CA12CA9ALDH1A1MEN1
SCHEMBL11605225 0.80 DPP4 (0.45) CASP3CA12CA9GLSDPP4
SCHEMBL11848701 0.80 TDP1 (0.51) GLSMEN1KMT2AMAPT
SCHEMBL11840055 0.80 TDP1 (0.56) MAPTHPGD

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2352876-A1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS BASF SE (DE) 2011-08-10 EP claimed
WO-2010052153-A1 TREATED TEXTILE MATERIAL FOR USE IN AQUATIC ENVIRONMENTS BASF SE (DE) 2010-05-14 WO claimed
EP-0273457-A2 Antifouling paint NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1988-07-06 EP disclosed
EP-0245950-A2 Insecticidal n-substituted-n' - substituted-n, n'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-11-19 EP disclosed
US-4609676-A INSECTICIDES, MITICIDES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1986-09-02 US disclosed