SCHEMBL20586166

SCHEMBL20586166

COc1ccc(CN(c2ncns2)S(=O)(=O)c2cc(Cl)c(NC(=O)O)cc2F)c(OC)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 6/20 0.38
ALDH1A1 P00352 5/20 0.38
SCN9A Q15858 1/20 0.37
POLB P06746 2/20 0.36
TSHR P16473 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL1093593 0.88 SCN9A (0.40) KDM4EMEN1KMT2AALDH1A1SCN9A
SCHEMBL29736437 0.88 SCN9A (0.40) KDM4EMEN1KMT2AALDH1A1SCN9A
SCHEMBL20449434 0.88 SCN9A (0.39) KDM4EMEN1KMT2ALMNAALDH1A1
SCHEMBL18983094 0.88 SCN9A (0.36) KDM4EMEN1KMT2ALMNAALDH1A1
SCHEMBL20528519 0.87 SCN9A (0.38) KDM4EMEN1KMT2ALMNAALDH1A1
SCHEMBL21217356 0.86 SCN9A (0.36) KDM4EMEN1KMT2ALMNAALDH1A1
SCHEMBL22035070 0.86 SCN9A (0.39) KDM4EMEN1KMT2AALDH1A1SCN9A
SCHEMBL28912753 0.86 SCN9A (0.39) KDM4EMEN1KMT2ALMNAALDH1A1
SCHEMBL28548900 0.86 SCN9A (0.39) KDM4EMEN1KMT2AALDH1A1SCN9A
SCHEMBL29835251 0.84 SCN9A (0.42) KDM4EMEN1KMT2ALMNAALDH1A1

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-20180362518-A1 DIAMINO-ALKYLAMINO-Linked ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS MERCK SHARP & DOHME CORP. (US) 2018-12-20 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-20180362518-A1 DIAMINO-ALKYLAMINO-Linked ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS TRPV1, SCN7A, SCN1A KDM4E 1802/4885MEN1 2824/4885KMT2A 2448/4885

“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.