SCHEMBL3355271

SCHEMBL3355271

O=S(=O)(Nc1ccc2c(c1)CNCCC2)c1c(Cl)nc2sccn12

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.58
HTR2C P28335 2/20 0.58
ADRA2A P08913 2/20 0.58

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
SCHEMBL13757801 0.94 HTR6 (0.60) HTR6HTR2CADRA2A
Hydrochloric Acid SCHEMBL9958981 0.93 HTR6 (0.59) HTR6HTR2CADRA2A
SCHEMBL13757741 0.90 HTR6 (0.60) HTR6HTR2CADRA2A
Hydrochloric Acid SCHEMBL3152645 0.90 HTR6 (0.59) HTR6HTR2CADRA2A
SCHEMBL1421964 0.89 HTR6 (0.62) HTR6HTR2CADRA2A
SCHEMBL1421915 0.89 HTR6 (0.62) HTR6HTR2CADRA2A
SCHEMBL12659638 0.82 HTR6 (0.58) HTR6HTR2CADRA2A
SCHEMBL1423764 0.82 HTR6 (0.61) HTR6HTR2CADRA2A
Hydrochloric Acid SCHEMBL1423303 0.81 HTR6 (0.59) HTR6HTR2CADRA2A
SCHEMBL13757800 0.81 HTR6 (0.61) HTR6HTR2CADRA2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105657-A1 Compounds, Process for their Preparation, Intermediates, Pharmaceutical Compositions and their use in the Treatment of 5-HT6 Mediated Disorders such as Alzheimer's Disease, Cognitive Disorders, Cognitive Impairment Associated with Schizophrenia, Obesity and Parkinson's Disease ASTRAZENECA AB (SE) 2010-04-29 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-20100105657-A1 Compounds, Process for their Preparation, Intermediates, Pharmaceutical Compositions and their use in the Treatment of 5-HT6 Mediated Disorders such as Alzheimer's Disease, Cognitive Disorders, Cognitive Impairment Associated with Schizophrenia, Obesity and Parkinson's Disease HTR6, HTR3B, HTR5A HTR6 1/4885HTR2C 10/4885ADRA2A 117/4885

“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.