SCHEMBL12778409

SCHEMBL12778409

CO/N=C(\C)c1cc(Cl)ccc1NS(=O)(=O)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.41
PTGS2 P35354 4/20 0.41
CA2 P00918 3/20 0.41
MRGPRX1 Q96LB2 4/20 0.41
ELANE P08246 2/20 0.39
PRTN3 P24158 2/20 0.39
ACLY P53396 1/20 0.38
CCR9 P51686 2/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
CA1 P00915 1/20 0.36

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
SCHEMBL12778410 0.88 MRGPRX1 (0.41) PTGS1PTGS2CA2MRGPRX1ACLY
SCHEMBL12778833 0.88 PTGS1 (0.40) PTGS1PTGS2CA2MRGPRX1ACLY
SCHEMBL12778567 0.87 PTGS1 (0.44) PTGS1PTGS2CA2MRGPRX1CCR9
SCHEMBL12778623 0.87 PTGS1 (0.39) PTGS1PTGS2CA2MRGPRX1ACLY
SCHEMBL2081633 0.86 MRGPRX1 (0.39) PTGS1PTGS2CA2MRGPRX1ACLY
SCHEMBL2081631 0.86 MRGPRX1 (0.39) PTGS1PTGS2CA2MRGPRX1ACLY
SCHEMBL12778748 0.86 MRGPRX1 (0.45) PTGS1PTGS2CA2MRGPRX1ACLY
SCHEMBL12778566 0.86 KMT2A (0.45) PTGS1PTGS2CA2MRGPRX1ACLY
SCHEMBL12778407 0.85 MRGPRX1 (0.41) PTGS1PTGS2CA2MRGPRX1ACLY
SCHEMBL12778439 0.85 SLC22A12 (0.43) PTGS1PTGS2CA2ELANEPRTN3

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
US-7906538-B2 Parasiticides; nematocides; crop protection SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2011-03-15 US disclosed
US-20080262048-A1 CONTROL OF PARASITES IN ANIMALS BY THE USE OF NOVEL TRIFLUOROMETHANESULFONANILIDE OXIME ETHER DERIVATIVES SCHERING-PLOUGH ANIMAL HEALTH CORPORATION 2008-10-23 US disclosed
US-7312248-B2 Control of parasites in animals by the use of novel trifluoromethanesulfonanilide oxime ether derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2007-12-25 US disclosed
US-7312248-B2 Control of parasites in animals by the use of novel trifluoromethanesulfonanilide oxime ether derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2007-12-25 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-20080262048-A1 CONTROL OF PARASITES IN ANIMALS BY THE USE OF NOVEL TRIFLUOROMETHANESULFONANILIDE OXIME ETHER DERIVATIVES TRHDE, EPX, EPHX1 PTGS1 1610/4885PTGS2 1554/4885CA2 2298/4885

“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.