SCHEMBL7098074

SCHEMBL7098074

CN(C)S(=O)(=O)n1cnc(C(=O)c2cccc([N+](=O)[O-])c2CO)c1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 1/20 0.34
TSHR P16473 1/20 0.33
ALDH1A1 P00352 4/20 0.32
MAPT P10636 4/20 0.32
MAPK1 P28482 2/20 0.32
PKM P14618 2/20 0.32
LMNA P02545 2/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
KDM4E B2RXH2 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CTSD P07339 1/20 0.31

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
SCHEMBL7103291 0.69 TDP1 (0.38) TSHRALDH1A1MAPTMAPK1PKM
SCHEMBL7097377 0.68 TDP1 (0.39) TSHRALDH1A1MAPTPKMKDM4E
SCHEMBL7100881 0.67 ALDH1A1 (0.41) TSHRALDH1A1MAPTGAAKDM4E
SCHEMBL8478132 0.66 TSHR (0.60) TSHRALDH1A1MAPTGAAKDM4E
SCHEMBL7103262 0.66 SMN1; SMN2 (0.34) ALDH1A1MAPTLMNAGAAKDM4E
SCHEMBL7101713 0.65 SMN1; SMN2 (0.33) ALDH1A1MAPTLMNAGAAHPGD
SCHEMBL7097291 0.65 MAPT (0.35) ALDH1A1MAPTMAPK1LMNAGAA
SCHEMBL7100870 0.65 HTT (0.42) ALDH1A1LMNAHPGDKDM4EKMT2A
SCHEMBL514833 0.64 GPR35 (0.58) TSHRALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL3311158 0.64 DCTPP1 (0.39) ALDH1A1MAPTLMNAGAA

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 ESRRA 1104/4885TSHR 155/4885ALDH1A1 263/4885

“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.