SCHEMBL7009075

SCHEMBL7009075

O=S(=O)(CCCl)c1ccc2cc(Cl)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.46
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
CYP2A6 P11509 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
SCHEMBL7018080 0.90 F10 (0.45) F10
SCHEMBL7009093 0.84 CA2 (0.49) F10ALDH1A1HTT
SCHEMBL7015078 0.81 F10 (0.44) F10ALDH1A1HTT
SCHEMBL7015561 0.81 CA2 (0.51) F10ALDH1A1HTT
SCHEMBL426162 0.81 ALDH1A1 (0.52) ALDH1A1
SCHEMBL947731 0.80 ALDH1A1 (0.56) F10ALDH1A1HTT
SCHEMBL7017801 0.80 F10 (0.43) F10ALDH1A1HTT
SCHEMBL949128 0.80 F10 (0.54) F10ALDH1A1HTT
Hydrochloric Acid SCHEMBL7012167 0.80 F10 (0.43) F10ALDH1A1HTT
SCHEMBL8283278 0.79 F10 (0.53) F10ALDH1A1HTT

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 4317/4885HTT 864/4885

“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.