SCHEMBL3485901

SCHEMBL3485901

CN(C1CCN(C(=O)O)CC1)S(=O)(=O)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 13/20 0.71
▸ HTR2C P28335 12/20 0.71
▸ ALDH1A1 P00352 2/20 0.63
▸ KDM4E B2RXH2 1/20 0.63
▸ MEN1 O00255 1/20 0.63
▸ KMT2A Q03164 1/20 0.63
▸ L3MBTL1 Q9Y468 4/20 0.53
▸ LMNA P02545 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ GAA P10253 1/20 0.52
▸ SIGMAR1 Q99720 1/20 0.51
▸ HTR1A P08908 1/20 0.51
▸ DRD2 P14416 1/20 0.51
▸ HTR7 P34969 1/20 0.51
▸ CACNA1B Q00975 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
SCHEMBL2505847 0.82 ALDH1A1 (0.83) HTR2AHTR2CALDH1A1KDM4EMEN1
SCHEMBL12077352 0.81 ALDH1A1 (0.93) HTR2AHTR2CALDH1A1KDM4EMEN1
SCHEMBL4159760 0.78 ALDH1A1 (1.00) HTR2AHTR2CALDH1A1KDM4EMEN1
SCHEMBL18423593 0.78 MGLL (0.73) HTR2AHTR2CALDH1A1KDM4EMEN1
SCHEMBL8234997 0.77 CACNA1B (0.54) HTR2AHTR2CALDH1A1KDM4EMEN1
SCHEMBL13644749 0.76 HTR2A (0.62) HTR2AHTR2CALDH1A1KDM4EMEN1
SCHEMBL20399228 0.76 MGLL (0.48) HTR2AHTR2CALDH1A1KDM4EMEN1
SCHEMBL3485687 0.75 ALDH1A1 (0.71) HTR2AHTR2CALDH1A1KDM4EMEN1
SCHEMBL2896994 0.75 L3MBTL3 (0.46) SIGMAR1DRD2
SCHEMBL3485252 0.74 SIGMAR1 (0.59) HTR2AHTR2CALDH1A1KDM4EMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8791264-B2 Benzenesulfonamide compounds and their use as blockers of calcium channels PURDUE PHARMA L.P. (US) 2014-07-29 — — US disclosed
US-20100022595-A1 Benzenesulfonamide Compounds and Their Use as Blockers of Calcium Channels PURDUE PHARMA L.P. (CT) 2010-01-28 — — US disclosed
WO-2007118853-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS BLOCKERS OF CALCIUM CHANNELS EURO-CELTIQUE S.A. (LU) 2007-10-25 — — WO 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-20100022595-A1 Benzenesulfonamide Compounds and Their Use as Blockers of Calcium Channels CACNA1A, CACNA1E, CACNA1B HTR2A 499/4885HTR2C 431/4885ALDH1A1 2210/4885

“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.

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