SCHEMBL7016777

SCHEMBL7016777

O=C(O)CCCS(=O)(=O)c1ccc2ccc(Cl)cc2c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.51
F10 P00742 6/20 0.46
ALDH1A1 P00352 4/20 0.46
PPARD Q03181 2/20 0.45
PPARA Q07869 2/20 0.44
HTT P42858 1/20 0.44
OXER1 Q8TDS5 2/20 0.43
KMO O15229 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 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
SCHEMBL7010156 0.96 PPARG (0.52) PPARGF10ALDH1A1PPARDPPARA
SCHEMBL7013159 0.91 PPARG (0.51) PPARGF10ALDH1A1PPARDPPARA
SCHEMBL947731 0.87 ALDH1A1 (0.56) PPARGF10ALDH1A1HTTKDM4E
SCHEMBL5271948 0.84 ALDH1A1 (0.63) PPARGALDH1A1HTTKDM4EHPGD
SCHEMBL7017610 0.80 KMO (0.42) PPARGF10PPARDPPARAOXER1
SCHEMBL7015561 0.79 CA2 (0.51) F10ALDH1A1HTT
SCHEMBL7011461 0.78 ALDH1A1 (0.60) PPARGF10ALDH1A1PPARAHTT
SCHEMBL7018418 0.78 LMNA (0.48) ALDH1A1HTTKDM4EHPGD
SCHEMBL7011601 0.78 F10 (0.56) F10ALDH1A1HTTKDM4EHPGD
SCHEMBL949128 0.78 F10 (0.54) F10ALDH1A1HTTKDM4EHPGD

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 PPARG 4261/4885F10 717/4885ALDH1A1 4317/4885

“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.