SCHEMBL21077306

SCHEMBL21077306

O=S(=O)(c1cc(Br)c(OCCOS)c(Br)c1)c1cc(Br)c(OCCOS)c(Br)c1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRB P10828 7/20 0.34
THRA P10827 6/20 0.34
KLK1 P06870 1/20 0.34
HRH3 Q9Y5N1 2/20 0.33
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 2/20 0.31
CA3 P07451 1/20 0.31

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
SCHEMBL483839 0.80 MCHR1 (0.43) THRBTHRAKLK1HRH3CA1
SCHEMBL11022560 0.80 MCHR1 (0.43) THRBTHRAKLK1HRH3CA1
SCHEMBL2349299 0.80 KLK1 (0.39) THRBTHRAKLK1HRH3CA1
SCHEMBL11566263 0.79 KLK1 (0.41) THRBTHRAKLK1HRH3CA2
SCHEMBL4131111 0.78 THRA (0.32) THRBTHRAKLK1HRH3
SCHEMBL11577842 0.77 KLK1 (0.44) THRBTHRAKLK1HRH3CA2
SCHEMBL11174499 0.76 CA1 (0.36) THRBTHRAKLK1CA1CA2
SCHEMBL23332926 0.76 THRB (0.51) THRBTHRACA1CA2CA9
SCHEMBL6297163 0.76 ALDH1A1 (0.46)
SCHEMBL372606 0.73 THRB (0.47) THRBTHRAKLK1

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-10919017-B2 Aqueous dispersion, method for manufacturing the same, and image forming method FUJIFILM CORPORATION (JP) 2021-02-16 US disclosed
US-20190168182-A1 AQUEOUS DISPERSION, METHOD FOR MANUFACTURING THE SAME, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2019-06-06 US disclosed