SCHEMBL11686361

SCHEMBL11686361

COc1ccc(S(=O)(=O)O)cc1N=S(=O)=O.Nc1ccccc1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ FFAR4 Q5NUL3 1/20 0.36
▸ F2 P00734 3/20 0.36
▸ PRSS1 P07477 3/20 0.36
▸ PRSS2 P07478 3/20 0.36
▸ PRSS3 P35030 3/20 0.36
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ MMP1 P03956 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ MMP8 P22894 1/20 0.35
▸ MMP13 P45452 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ENPP2 Q13822 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ PRMT1 Q99873 1/20 0.34

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
SCHEMBL11684226 0.86 PTPN11 (0.39) PTPN11KMT2AFFAR4
SCHEMBL11684505 0.84 PTPN11 (0.39) PTPN11KMT2AFFAR4ENPP2
Aniline SCHEMBL11685584 0.83 ALDH1A1 (0.41) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL11682708 0.78 POLB (0.42) PTPN11KMT2AFFAR4SMN1; SMN2
SCHEMBL11682956 0.78 PTGS1 (0.39) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL11682454 0.78 SENP3 (0.44) PTPN11KMT2AFFAR4CA1CA2
SCHEMBL11685478 0.78 ALDH1A1 (0.44) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL11681974 0.76 CYP2C9 (0.41) KMT2AF2PRSS1PRSS2PRSS3
O-Tolylamine SCHEMBL11682944 0.76 PHLPP2 (0.38) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL11682813 0.72 POLB (0.41) PTPN11KMT2AFFAR4SMN1; SMN2

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-4055557-A MONOAZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-10-25 — — US disclosed
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