SCHEMBL8981691

SCHEMBL8981691

O=S(=O)(NCCCCN1CCc2ccccc2C1)c1cc(F)c(Cl)cc1F

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 12/20 0.63
HTR6 P50406 2/20 0.55
HTR1A P08908 1/20 0.44
DRD2 P14416 1/20 0.44
HTR2A P28223 1/20 0.44
SLC6A4 P31645 1/20 0.44
HRH1 P35367 1/20 0.44
DRD3 P35462 1/20 0.44
HTR2B P41595 1/20 0.44

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
SCHEMBL14502611 0.99 HTR7 (0.62) HTR7HTR6HTR1ADRD2HTR2A
Hydrochloric Acid SCHEMBL4228346 0.99 HTR7 (0.62) HTR7HTR6HTR1ADRD2HTR2A
SCHEMBL8981856 0.96 HTR7 (0.63) HTR7HTR6HTR1ADRD2HTR2A
Hydrochloric Acid SCHEMBL4219434 0.95 HTR7 (0.62) HTR7HTR6HTR1ADRD2HTR2A
SCHEMBL8981640 0.93 HTR7 (0.64) HTR7HTR6HTR1ADRD2HTR2A
Hydrochloric Acid SCHEMBL4221696 0.92 HTR7 (0.63) HTR7HTR6HTR1ADRD2HTR2A
SCHEMBL8981627 0.92 HTR7 (0.68) HTR7HTR6HTR1ADRD2HTR2A
Hydrochloric Acid SCHEMBL4218317 0.91 HTR7 (0.67) HTR7HTR6HTR1ADRD2HTR2A
SCHEMBL8980463 0.88 HTR7 (0.63) HTR7HTR6HTR1ADRD2HTR2A
Hydrochloric Acid SCHEMBL4228093 0.87 HTR7 (0.62) HTR7HTR6HTR1ADRD2HTR2A

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 6 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-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-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
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 1/4885HTR6 7/4885HTR1A 2/4885

“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.