SCHEMBL8980455

SCHEMBL8980455

O=S(=O)(NCCCCCN1CCc2ccccc2C1)c1cc(Cl)c(Cl)cc1Cl

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 10/20 0.67
HTR6 P50406 2/20 0.57
HDAC3 O15379 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
NCOR2 Q9Y618 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
SCHEMBL8982865 1.00 HTR7 (0.67) HTR7HTR6HDAC3HDAC1HDAC2
Hydrochloric Acid SCHEMBL4230262 0.99 HTR7 (0.65) HTR7HTR6HDAC3HDAC1HDAC2
Hydrochloric Acid SCHEMBL4223182 0.99 HTR7 (0.65) HTR7HTR6HDAC3HDAC1HDAC2
SCHEMBL8980307 0.99 HTR7 (0.68) HTR7HTR6
Hydrochloric Acid SCHEMBL4226152 0.98 HTR7 (0.67) HTR7HTR6
SCHEMBL10035525 0.96 HTR7 (0.67) HTR7HTR6
Hydrochloric Acid SCHEMBL2139732 0.94 HTR7 (0.66) HTR7HTR6
SCHEMBL8982831 0.89 HTR7 (0.64) HTR7HTR6
SCHEMBL8980868 0.89 HTR7 (0.64) HTR7HTR6
SCHEMBL8980732 0.89 HTR7 (0.64) 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 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 7/4885HDAC3 2350/4885

“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.