SCHEMBL3470566

SCHEMBL3470566

Cc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.67
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
LMNA P02545 3/20 0.67
MAPT P10636 3/20 0.67
HTT P42858 3/20 0.67
SLC5A1 P13866 1/20 0.67
NCOA1 Q15788 1/20 0.67
NCOA3 Q9Y6Q9 1/20 0.67
ALDH1A1 P00352 4/20 0.65
MAPK1 P28482 2/20 0.65
NFKBIA P25963 1/20 0.65
RELA Q04206 1/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
MCL1 Q07820 1/20 0.58
NHERF1 O14745 1/20 0.55
PDE2A O00408 1/20 0.54
PDE5A O76074 1/20 0.54
CYP3A4 P08684 1/20 0.54
ALOX15 P16050 1/20 0.54

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
SCHEMBL7571583 0.88 MEN1 (0.63) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL30218132 0.88 TSHR (0.58) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL15647549 0.88 NFKBIA (0.61) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL23832700 0.88 TSHR (0.58) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL25754724 0.86 L3MBTL1 (0.61) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL2241186 0.86 ALPL (0.60) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL27181384 0.85 KMT2A (0.80) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL7572373 0.84 L3MBTL1 (0.67) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL15821362 0.83 L3MBTL1 (0.55) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL7571516 0.83 NFKBIA (0.62) SMN1; SMN2MEN1KMT2ALMNAMAPT

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-20100317706-A1 HNF4alpha MODULATORS AND METHODS OF USE BUMHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-12-16 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-20100317706-A1 HNF4alpha MODULATORS AND METHODS OF USE HNF4A, NCOA4, NR4A3 SMN1; SMN2 4488/4885MEN1 4481/4885KMT2A 1141/4885

“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.