SCHEMBL24980451

SCHEMBL24980451

COc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cn1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.65
KMT2A Q03164 7/20 0.65
PABPC1 P11940 2/20 0.65
HTT P42858 5/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
NPC1 O15118 1/20 0.59
LMNA P02545 6/20 0.57
ALDH1A1 P00352 4/20 0.57
MAPT P10636 4/20 0.57
TSHR P16473 3/20 0.57
ALOX15 P16050 2/20 0.57
USP2 O75604 2/20 0.57
HPGD P15428 1/20 0.57
TP53 P04637 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
KDM4E B2RXH2 1/20 0.56
POLB P06746 1/20 0.56
SLC22A12 Q96S37 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.53
ADORA3 P0DMS8 1/20 0.51

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
SCHEMBL1037705 0.83 MEN1 (0.59) MEN1KMT2APABPC1HTTSMN1; SMN2
SCHEMBL5335902 0.81 MEN1 (0.57) MEN1KMT2APABPC1HTTSMN1; SMN2
SCHEMBL1038586 0.79 MEN1 (0.65) MEN1KMT2APABPC1HTTSMN1; SMN2
SCHEMBL6087090 0.78 MEN1 (0.60) MEN1KMT2APABPC1HTTSMN1; SMN2
SCHEMBL24980040 0.78 KMT2A (0.44) MEN1KMT2APABPC1HTTSMN1; SMN2
SCHEMBL16492687 0.77 KDM4E (0.58) MEN1KMT2APABPC1HTTSMN1; SMN2
SCHEMBL24980449 0.76 PIK3CB (0.59) KMT2AHTTSMN1; SMN2LMNAALDH1A1
SCHEMBL9413326 0.76 POLB (0.56) MEN1KMT2APABPC1HTTSMN1; SMN2
SCHEMBL7258442 0.75 KDM4E (0.57) MEN1KMT2APABPC1HTTSMN1; SMN2
SCHEMBL19259536 0.75 KDM4E (0.57) MEN1KMT2APABPC1HTTSMN1; SMN2

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-20230032020-A1 SMALL-MOLECULE COVALENT INHIBITION OF RAL GTPASES NATIONAL INSTITUTES OF HEALTH 2023-02-02 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-20230032020-A1 SMALL-MOLECULE COVALENT INHIBITION OF RAL GTPASES RALA, KRAS, HRAS MEN1 2431/4885KMT2A 487/4885PABPC1 3508/4885

“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.