SCHEMBL15747005

SCHEMBL15747005

O=C(NS(=O)(=O)c1ccccc1)c1cccc(-c2cnn(-c3cncc(F)c3)c2)n1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 9/20 0.49
PTGS1 P23219 8/20 0.49
KAT6A Q92794 7/20 0.45
EGFR P00533 2/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
FGFR1 P11362 1/20 0.39
KDR P35968 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39

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
SCHEMBL253887 0.88 IRAK4 (0.40) PTGS2PTGS1KAT6AIRAK4
SCHEMBL10233599 0.88 PTGS2 (0.54) PTGS2PTGS1KAT6AEGFRKEAP1
SCHEMBL10233337 0.86 P4HTM (0.38) KAT6AIRAK4
SCHEMBL10233521 0.86 IRAK4 (0.39) PTGS2PTGS1IRAK4
SCHEMBL10233605 0.86 PTGS2 (0.52) PTGS2PTGS1KAT6AEGFRKEAP1
SCHEMBL10182013 0.85 NTRK1 (0.40) PTGS2PTGS1IRAK4
SCHEMBL15747023 0.84 SCN9A (0.48) IRAK4
SCHEMBL10233607 0.83 IRAK4 (0.37) PTGS2PTGS1IRAK4
SCHEMBL2626897 0.81 PTGS2 (0.56) PTGS2PTGS1KAT6AEGFRKEAP1
SCHEMBL18567909 0.80 IRAK4 (0.41) IRAK4

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-9044015-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2015-06-02 US disclosed
US-20140148471-A1 Heterocyclic Compounds as Pesticides BAYER CROPSCIENCE AG (DE) 2014-05-29 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-20140148471-A1 Heterocyclic Compounds as Pesticides DDT, ACHE, PTMS PTGS2 2119/4885PTGS1 2788/4885KAT6A 4029/4885

“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.