SCHEMBL7102037

SCHEMBL7102037

CS(=O)(=O)N(Cc1ccccc1)c1ccc(F)c2c1CCC=C2c1c[nH]cn1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
CYP3A4 P08684 1/20 0.34
HTT P42858 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
SCHEMBL7097701 0.84 ALDH1A1 (0.39) ALDH1A1
SCHEMBL7098736 0.73 ALDH1A1 (0.41) ALDH1A1CYP3A4HTT
SCHEMBL7103398 0.68 ALDH1A1 (0.41) ALDH1A1HTT
SCHEMBL18438489 0.68 ALDH1A1 (0.62) ALDH1A1
SCHEMBL7104848 0.61 ADRA2A (0.33)
SCHEMBL17595436 0.59 ALDH1A1 (0.49) ALDH1A1CYP3A4
SCHEMBL7147951 0.58 ALDH1A1 (0.42) ALDH1A1
SCHEMBL12808838 0.57 ALDH1A1 (0.60) ALDH1A1HTT
SCHEMBL6863294 0.57 LMNA (0.45) ALDH1A1HTT
SCHEMBL10560727 0.56 CYP3A4 (0.69) ALDH1A1CYP3A4

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 2 patents. 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
US-6503935-B1 Treating urinary incontinence or retrograde ejaculation ABBOTT LABORATORIES 2003-01-07 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 ALDH1A1 263/4885CYP3A4 720/4885HTT 4621/4885

“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.