SCHEMBL8979752

SCHEMBL8979752

O=S(=O)(NCCCCN1CCc2ccccc2C1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 13/20 0.72
HTR6 P50406 4/20 0.60
HTR1A P08908 2/20 0.53
HTR2A P28223 2/20 0.53
HTR2C P28335 2/20 0.53
TP53 P04637 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.48

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 SCHEMBL4226158 0.99 HTR7 (0.71) HTR7HTR6HTR1AHTR2AHTR2C
SCHEMBL8983484 0.87 HTR7 (0.54) HTR7HTR6HTR1AHTR2AHTR2C
SCHEMBL8980186 0.86 HTR7 (0.77) HTR7HTR6HTR1AHTR2ATP53
Hydrochloric Acid SCHEMBL4217646 0.86 HTR7 (0.53) HTR7HTR6HTR1AHTR2AHTR2C
SCHEMBL8982797 0.85 HTR7 (0.76) HTR7HTR6HTR1ATP53L3MBTL1
SCHEMBL8980374 0.85 HTR7 (0.76) HTR7HTR6HTR1ATP53L3MBTL1
Hydrochloric Acid SCHEMBL4228553 0.85 HTR7 (0.76) HTR7HTR6HTR1AHTR2ATP53
SCHEMBL8980537 0.85 HTR7 (0.79) HTR7HTR6HTR1ATP53L3MBTL1
SCHEMBL8979759 0.85 HTR7 (1.00) HTR7HTR6HTR1AHTR2A
Hydrochloric Acid SCHEMBL4228195 0.84 HTR7 (0.74) HTR7HTR6HTR1AHTR2ATP53

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.