SCHEMBL8980257

SCHEMBL8980257

O=S(=O)(NCCCCN1CCc2ccccc2C1)c1cccc(Cl)c1Cl

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 13/20 0.72
HTR6 P50406 4/20 0.55
CCR1 P32246 1/20 0.53
HTR1A P08908 3/20 0.49
HTR2A P28223 2/20 0.49
DRD2 P14416 2/20 0.48
DRD4 P21917 1/20 0.47
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47
DRD3 P35462 1/20 0.47

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 SCHEMBL4231258 0.99 HTR7 (0.70) HTR7HTR6CCR1HTR1AHTR2A
SCHEMBL8980511 0.99 HTR7 (0.70) HTR7HTR6CCR1HTR1AHTR2A
Hydrochloric Acid SCHEMBL4228335 0.98 HTR7 (0.69) HTR7HTR6CCR1HTR1AHTR2A
SCHEMBL10035529 0.97 HTR7 (0.67) HTR7HTR6CCR1
Hydrochloric Acid SCHEMBL2137678 0.96 HTR7 (0.66) HTR7HTR6CCR1
SCHEMBL8981828 0.92 HTR7 (0.72) HTR7HTR6CCR1DRD2DRD3
SCHEMBL8981835 0.91 HTR7 (0.67) HTR7HTR6HTR1ADRD2DRD3
Hydrochloric Acid SCHEMBL4226923 0.91 HTR7 (0.71) HTR7HTR6CCR1
Hydrochloric Acid SCHEMBL4220354 0.90 HTR7 (0.65) HTR7HTR6
SCHEMBL8980661 0.89 HTR7 (0.72) HTR7HTR6CCR1HTR1ADRD2

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 7/4885CCR1 1348/4885

“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.