SCHEMBL8982183

SCHEMBL8982183

COc1cccc(S(=O)(=O)NCCCCN2CCc3ccc([N+](=O)O)cc3C2)c1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 9/20 0.54
DRD3 P35462 2/20 0.48
DRD2 P14416 1/20 0.48
DRD4 P21917 1/20 0.47
HTR6 P50406 2/20 0.47
SIGMAR1 Q99720 1/20 0.46

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
Hydrochloric Acid SCHEMBL4228381 0.91 HTR7 (0.55) HTR7HTR6SIGMAR1
SCHEMBL8982078 0.90 HTR7 (0.61) HTR7HTR6
SCHEMBL8982110 0.89 HTR7 (0.57) HTR7DRD2HTR6
SCHEMBL8982114 0.88 HTR7 (0.58) HTR7DRD2HTR6
SCHEMBL8982117 0.87 SIGMAR1 (0.55) HTR7HTR6SIGMAR1
SCHEMBL8982569 0.87 HTR7 (0.57) HTR7DRD2HTR6
SCHEMBL8980490 0.86 HTR7 (0.72) HTR7HTR6
SCHEMBL8982103 0.86 HTR7 (0.53) HTR7DRD3DRD4SIGMAR1
SCHEMBL8982366 0.85 SIGMAR1 (0.51) HTR7DRD3DRD2DRD4SIGMAR1
Hydrochloric Acid SCHEMBL4216134 0.85 HTR7 (0.71) HTR7HTR6

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-8188115-B2 5-HT7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2012-05-29 US disclosed
US-20090163542-A1 5-ht7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-06-25 US disclosed
US-7211585-B2 5-HT7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-05-01 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-20090163542-A1 5-ht7 receptor antagonists HTR7, HTR1A, HTR5A HTR7 1/4885DRD3 122/4885DRD2 39/4885

“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.