SCHEMBL7011601

SCHEMBL7011601

O=C(O)NCCCS(=O)(=O)c1ccc2cc(Cl)ccc2c1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.56
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.42
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL7017324 0.96 F10 (0.53) F10ALDH1A1KDM4EHPGDHTT
SCHEMBL2347265 0.86 KMT2A (0.53) ALDH1A1KDM4EHTTGAAKMT2A
SCHEMBL7016117 0.82 CA1 (0.51) F10ALDH1A1HPGDHTT
SCHEMBL7010156 0.82 PPARG (0.52) F10ALDH1A1HTT
SCHEMBL7013159 0.81 PPARG (0.51) F10ALDH1A1HTT
Trifluoroacetic Acid SCHEMBL7014625 0.80 F10 (0.46) F10ALDH1A1KDM4EHPGD
SCHEMBL7017443 0.80 F10 (0.45) F10ALDH1A1KDM4EHPGDHTT
SCHEMBL7015561 0.80 CA2 (0.51) F10ALDH1A1HTT
SCHEMBL7008974 0.80 F10 (0.47) F10ALDH1A1KDM4EHPGD
SCHEMBL7010697 0.79 F10 (0.47) F10ALDH1A1KDM4EHPGDKMT2A

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 F10 717/4885ALDH1A1 4317/4885KDM4E 533/4885

“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.