SCHEMBL7698077

SCHEMBL7698077

CC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCCN2CCCOc2ccc(-c3ccccn3)cc2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.47
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.39
HTR3A P46098 4/20 0.39
F2 P00734 1/20 0.39
F10 P00742 1/20 0.39
HTR1A P08908 1/20 0.39
HTR2A P28223 1/20 0.39
CHRM2 P08172 1/20 0.38
SLC6A2 P23975 1/20 0.38
ADRA1A P35348 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL5215453 1.00 HRH3 (0.47) HRH3KMT2AALDH1A1HTR3AF2
SCHEMBL5214982 0.86 HRH2 (0.47) HRH3KMT2AALDH1A1
SCHEMBL5216837 0.86 HRH3 (0.49) HRH3KMT2AALDH1A1
SCHEMBL5214782 0.84 HRH2 (0.51) HRH3ALDH1A1
SCHEMBL5246429 0.83 HRH3 (0.46) HRH3HTR3AF2F10HTR1A
SCHEMBL5214957 0.83 HRH3 (0.53) HRH3HTR3AF2F10CHRM2
SCHEMBL6848186 0.83 ALDH1A1 (0.39) HRH3KMT2AALDH1A1HTR1AHTR2A
SCHEMBL5215703 0.83 HRH3 (0.51) HRH3KMT2AHTR3AF2F10
SCHEMBL5214173 0.82 HRH3 (0.51) HRH3HTR3AF2F10HTR1A
SCHEMBL5218075 0.80 HRH3 (0.50) HRH3KMT2AHTR3AF2F10

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-20020137931-A1 1,3-disubstituted and 1,3,3-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications ABBVIE INC. 2002-09-26 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-20020137931-A1 1,3-disubstituted and 1,3,3-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications HRH3, HRH4, HRH1 HRH3 1/4885KMT2A 2791/4885ALDH1A1 962/4885

“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.