SCHEMBL7018250

SCHEMBL7018250

Cc1c(S(=O)(=O)CCC(=O)O)sc2ccc(Cl)cc12

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PFKFB3 Q16875 7/20 0.53
PFKFB4 Q16877 7/20 0.53
CMA1 P23946 7/20 0.52
NPSR1 Q6W5P4 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
AKR1B1 P15121 1/20 0.47
MAPT P10636 1/20 0.44
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL3679315 0.81 PFKFB3 (0.44) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
SCHEMBL3695829 0.81 CMA1 (0.46) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
SCHEMBL2226181 0.78 NPSR1 (0.60) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
Hydrochloric Acid SCHEMBL6712744 0.76 NPSR1 (0.59) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
SCHEMBL1548591 0.76 NPSR1 (0.62) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
SCHEMBL337593 0.76 NPSR1 (0.62) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
SCHEMBL13696908 0.76 NPSR1 (0.62) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
SCHEMBL7012927 0.74 KEAP1 (0.42) NPSR1ALDH1A1
SCHEMBL3679313 0.73 PFKFB3 (0.43) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
SCHEMBL3695828 0.73 CMA1 (0.43) PFKFB3PFKFB4CMA1NPSR1L3MBTL1

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-20030187023-A1 Sulfone derivatives, process for their production and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-10-02 US disclosed
EP-1302462-A1 SULFONE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-04-16 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030187023-A1 Sulfone derivatives, process for their production and use thereof SULT1E1, RRS1, SHH PFKFB3 2877/4885PFKFB4 2630/4885CMA1 2700/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.