SCHEMBL6196846

SCHEMBL6196846

CC1C(CO)N(C(=O)c2ccc(-c3cccc[n+]3[O-])cc2)CCN1S(=O)(=O)c1ccc2cc(Cl)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.40
F2 P00734 6/20 0.36
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
TSHR P16473 1/20 0.34
CYP2C19 P33261 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PTGDR2 Q9Y5Y4 3/20 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
SCHEMBL6196557 0.78 F10 (0.41) F10F2CYP3A4CYP2D6CYP2C9
SCHEMBL6200479 0.78 F10 (0.52) F10F2
SCHEMBL6198707 0.77 F10 (0.57) F10F2
Hydrochloric Acid SCHEMBL6200415 0.75 F10 (0.41) F10F2
SCHEMBL6199619 0.74 F10 (0.44) F10F2
Hydrochloric Acid SCHEMBL6198414 0.74 F10 (0.44) F10F2
SCHEMBL6200178 0.72 F10 (0.40) F10F2
Hydrochloric Acid SCHEMBL6198923 0.71 MGLL (0.37) F10CYP3A4CYP2C19
SCHEMBL6197220 0.70 ALDH1A1 (0.39) F10F2CYP3A4CYP2D6CYP2C9
Iodide SCHEMBL6200287 0.69 F10 (0.55) F10

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1031563-B1 SULFONYL DERIVATIVES DAIICHI SEIYAKU CO (JP) 2005-12-28 EP disclosed
US-20030232808-A1 Sulfonyl derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-12-18 US disclosed
US-6525042-B1 Inhibits an activated coagulation factor FXa; anticoagulant, antithrombotic DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-02-25 US disclosed
EP-1031563-A1 SULFONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-08-30 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-20030232808-A1 Sulfonyl derivatives SULT1E1, SULT2A1, SULT1A1 F10 76/4885F2 4/4885CYP3A4 489/4885

“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.