SCHEMBL7101713

SCHEMBL7101713

CN(C)S(=O)(=O)n1cnc(C2OCc3c2cccc3[N+](=O)[O-])c1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 4/20 0.32
MAPT P10636 4/20 0.32
LMNA P02545 2/20 0.31
GAA P10253 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL7097377 0.66 TDP1 (0.39) SMN1; SMN2ALDH1A1MAPT
SCHEMBL7667658 0.66 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1MAPTLMNAGAA
SCHEMBL7098074 0.65 ESRRA (0.34) ALDH1A1MAPTLMNAGAAMEN1
SCHEMBL7103291 0.65 TDP1 (0.38) SMN1; SMN2ALDH1A1MAPTLMNAMEN1
SCHEMBL7103262 0.64 SMN1; SMN2 (0.34) SMN1; SMN2ALDH1A1MAPTLMNAGAA
SCHEMBL7100881 0.63 ALDH1A1 (0.41) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL7101733 0.62 ALDH1A1 (0.31) ALDH1A1MAPT
SCHEMBL27818934 0.62 MAPT (0.40) SMN1; SMN2ALDH1A1MAPTLMNAGAA
SCHEMBL7100452 0.61 KMT2A (0.44) SMN1; SMN2ALDH1A1MAPTLMNAGAA
SCHEMBL7101641 0.60 MEN1 (0.39) SMN1; SMN2ALDH1A1MAPTGAAMEN1

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-20030073850-A1 4-Imidazole derivatives of benzyl and restricted benzyl sulfonamides, sulfamides, ureas, carbamates, and amides and their use ABBOTT LABORATORIES 2003-04-17 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-20030073850-A1 4-Imidazole derivatives of benzyl and restricted benzyl sulfonamides, sulfamides, ureas, carbamates, and amides and their use ADRA1D, ADRB1, ADRA1A SMN1; SMN2 639/4885ALDH1A1 263/4885MAPT 4075/4885

“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.