SCHEMBL3316403

SCHEMBL3316403

O=S(=O)(c1ccccc1)c1cc(I)ccc1I

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
GAA P10253 1/20 0.49
GFER P55789 1/20 0.49
HTR6 P50406 7/20 0.48
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
KIF18A Q8NI77 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
RAPGEF4 Q8WZA2 1/20 0.37
RAD51 Q06609 1/20 0.37
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL3834739 0.79 HTR6 (0.57) POLBGAAGFERHTR6KMT2A
SCHEMBL8763518 0.76 HTR6 (0.44) HTR6KMT2ATSHRHTTCA1
SCHEMBL3835169 0.74 HTR6 (0.70) POLBHTR6KMT2AALDH1A1TSHR
SCHEMBL3839132 0.74 HTR6 (0.61) POLBGAAGFERHTR6KMT2A
SCHEMBL10040107 0.73 KIF18A (0.68) POLBGAAGFERHTR6KMT2A
SCHEMBL8080841 0.71 HTR6 (0.72) POLBGAAGFERHTR6KMT2A
SCHEMBL197382 0.71 RAD51 (0.41) TSHRCA1CA2RAPGEF4RAD51
SCHEMBL9488438 0.71 HTR6 (0.52) POLBGAAGFERHTR6KMT2A
(Phenylsulfonyl)Benzene SCHEMBL28730795 0.69 HTR6 (0.88) POLBGAAGFERHTR6ALDH1A1
(Phenylsulfonyl)Benzene SCHEMBL13735236 0.68 HTR6 (1.00) POLBHTR6ALDH1A1TSHRCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105786-A1 Method for Producing Polymer Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-29 US disclosed
EP-1721922-A1 METHOD FOR PRODUCING POLYMER COMPOUND Sumitomo Chemical Company, Limited (JP) 2006-11-15 EP disclosed