SCHEMBL6001650

SCHEMBL6001650

O=S(=O)(Nc1ccc(Cl)cc1Nc1ccc(Cl)cc1)C(F)(F)F

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 19/20 0.67
PTGS2 P35354 17/20 0.67
CA2 P00918 1/20 0.48

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
SCHEMBL11330348 0.79 CA2 (0.67) PTGS1PTGS2CA2
SCHEMBL7524156 0.78 PTPN1 (0.63) PTGS1PTGS2CA2
SCHEMBL2079574 0.74 CA2 (0.49) PTGS1PTGS2CA2
SCHEMBL4968060 0.74 PTGS1 (0.50) PTGS1PTGS2CA2
SCHEMBL4972432 0.72 PTGS1 (0.70) PTGS1PTGS2CA2
SCHEMBL2080327 0.72 CA2 (0.47) PTGS1PTGS2CA2
SCHEMBL12778979 0.71 PTGS1 (0.44) PTGS1PTGS2CA2
SCHEMBL2076986 0.70 MRGPRX1 (0.46) PTGS1PTGS2CA2
SCHEMBL27241 0.70 ABL1 (0.47) PTGS1PTGS2CA2
SCHEMBL2080151 0.70 CA2 (0.45) PTGS1PTGS2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060281695-A1 Control of parasites in animals by N-[(phenyloxy)phenyl]-1,1,1-trifluoromethanesulfonamide and N-[(phenylsulfanyl)phenyl]-1,1,1-trifluoromethanesulfonamide derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION 2006-12-14 US 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-20060281695-A1 Control of parasites in animals by N-[(phenyloxy)phenyl]-1,1,1-trifluoromethanesulfonamide and N-[(phenylsulfanyl)phenyl]-1,1,1-trifluoromethanesulfonamide derivatives ELANE, CTRL, PIGO PTGS1 296/4885PTGS2 1435/4885CA2 3839/4885

“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.