SCHEMBL6743676

SCHEMBL6743676

CCNc1cc(N2CCNCC2)ccc1S(=O)(=O)c1cccc(F)c1

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.78
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
HTR1A P08908 1/20 0.45
DRD2 P14416 1/20 0.45
HTR2A P28223 1/20 0.45
HTR7 P34969 1/20 0.45

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
SCHEMBL6741078 0.96 HTR6 (0.80) HTR6ALDH1A1MAPTHTR1ADRD2
Hydrochloric Acid SCHEMBL6742041 0.95 HTR6 (0.79) HTR6ALDH1A1MAPTHTR1ADRD2
SCHEMBL6745003 0.92 HTR6 (0.71) HTR6ALDH1A1MAPTHTR1ADRD2
SCHEMBL6744551 0.90 HTR6 (0.76) HTR6ALDH1A1MAPT
SCHEMBL6747341 0.88 HTR6 (0.61) HTR6DRD2HTR2AHTR7
SCHEMBL6746185 0.88 HTR6 (0.78) HTR6ALDH1A1MAPTHTR1ADRD2
SCHEMBL7044626 0.88 HTR6 (0.80) HTR6ALDH1A1MAPT
SCHEMBL6741906 0.88 HTR6 (0.92) HTR6MAPTHTR1ADRD2HTR2A
SCHEMBL6743830 0.88 HTR6 (1.00) HTR6ALDH1A1MAPT
SCHEMBL6746870 0.87 HTR6 (0.70) HTR6ALDH1A1MAPT

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-20040014966-A1 Bis-arylsulfones JACOBSEN ERIC JON (US) 2004-01-22 US claimed
US-20040014966-A1 Bis-arylsulfones JACOBSEN ERIC JON (US) 2004-01-22 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-20040014966-A1 Bis-arylsulfones NPSR1, ARSA, SLC18A2 HTR6 69/4885ALDH1A1 1243/4885MAPT 1505/4885

“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.