SCHEMBL6406548

SCHEMBL6406548

O=C(NS(=O)(=O)c1ccccc1)c1cn2nc(Br)ccc2n1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.53
PTGS1 P23219 7/20 0.53
EGFR P00533 2/20 0.43
ALKBH2 Q6NS38 1/20 0.43
ALKBH5 Q6P6C2 1/20 0.43
FTO Q9C0B1 1/20 0.43
P4HTM Q9NXG6 2/20 0.41
KDM4E B2RXH2 1/20 0.41
FLT1 P17948 2/20 0.40
FLT4 P35916 2/20 0.40
KDR P35968 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL6406531 0.79 PTGS2 (0.49) PTGS2PTGS1EGFRALKBH2ALKBH5
SCHEMBL10204163 0.79 PTGS2 (0.55) PTGS2PTGS1EGFRALKBH2ALKBH5
SCHEMBL6403465 0.77 PTGS2 (0.56) PTGS2PTGS1EGFRALKBH2ALKBH5
SCHEMBL10204166 0.77 PTGS2 (0.55) PTGS2PTGS1EGFRALKBH2ALKBH5
SCHEMBL3659963 0.75 PTGS1 (0.44) PTGS2PTGS1KDM4EL3MBTL1
SCHEMBL10204165 0.75 PTGS2 (0.56) PTGS2PTGS1EGFRALKBH2ALKBH5
SCHEMBL10204162 0.74 NPC1 (0.63) PTGS2PTGS1ALKBH2ALKBH5FTO
SCHEMBL10182362 0.73 PTGS2 (0.79) PTGS2PTGS1EGFRALKBH2ALKBH5
SCHEMBL6415254 0.72 PTGS2 (0.55) PTGS2PTGS1EGFRALKBH2ALKBH5
SCHEMBL6400785 0.71 PTGS2 (0.51) PTGS2PTGS1EGFRALKBH2ALKBH5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9023850-B2 Nematocidal sulfonamides E I DU PONT DE NEMOURS AND COMPANY (US) 2015-05-05 US disclosed
US-9023850-B2 Nematocidal sulfonamides E I DU PONT DE NEMOURS AND COMPANY (US) 2015-05-05 US disclosed
EP-2629614-B1 NEMATOCIDAL SULFONAMIDES DU PONT (US) 2014-09-17 EP disclosed
US-20130190172-A1 NEMATOCIDAL SULFONAMIDES E I DU PONT DE NEMOURS AND COMPANY (US) 2013-07-25 US disclosed
US-20130190172-A1 NEMATOCIDAL SULFONAMIDES E I DU PONT DE NEMOURS AND COMPANY (US) 2013-07-25 US disclosed
WO-2012054233-A1 NEMATOCIDAL SULFONAMIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-04-26 WO 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-20130190172-A1 NEMATOCIDAL SULFONAMIDES QSOX1, ARSA, NOX1 PTGS2 995/4885PTGS1 304/4885EGFR 4463/4885

“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.