SCHEMBL9750422

SCHEMBL9750422

Nc1ccc(N=Nc2ccc(Cl)c(S(=O)(=O)CCOS(=O)(=O)O)c2)cc1S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SENP2 Q9HC62 11/20 0.38
SENP1 Q9P0U3 10/20 0.38
SENP3 Q9H4L4 7/20 0.38
SUMO2 P61956 7/20 0.38
SUMO1 P63165 7/20 0.38
SENP7 Q9BQF6 7/20 0.38
THRB P10828 3/20 0.35
CTDSP1 Q9GZU7 1/20 0.34
ALDH1A1 P00352 3/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
SLC7A11 Q9UPY5 2/20 0.33
HPGD P15428 2/20 0.33
RECQL P46063 2/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
CASP1 P29466 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.32

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
SCHEMBL9750092 0.90 SENP2 (0.40) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL9749721 0.85 THRB (0.47) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL7720103 0.84 SENP2 (0.47) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL8811065 0.84 PTGS1 (0.40) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL7718129 0.82 SENP2 (0.46) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL8008676 0.78 ALDH1A1 (0.44) THRBALDH1A1HPGDRECQLCYP3A4
SCHEMBL9749734 0.77 THRB (0.43) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL872920 0.75 CTDSP1 (0.40) SENP2SUMO2SUMO1SENP7THRB
SCHEMBL7716407 0.75 MEN1 (0.38) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL9750184 0.75 SENP2 (0.43) SENP2SENP1SENP3SUMO2SUMO1

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
US-5093484-A Water soluble; colorfast shades on cotton BAYER AKTIENGESELLSCHAFT (DE) 1992-03-03 US disclosed