SCHEMBL12428299

SCHEMBL12428299

COc1cc(C)nc2c(S(=O)(=O)c3ccccc3)c(SC)nn12

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.75
HTR2B P41595 1/20 0.58
KCNH2 Q12809 1/20 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
SCHEMBL12428282 0.88 HTR6 (0.77) HTR6
SCHEMBL7134694 0.86 HTR6 (0.78) HTR6HTR2BKCNH2
SCHEMBL3399354 0.86 HTR6 (1.00) HTR6HTR2B
SCHEMBL7138420 0.84 HTR6 (0.78) HTR6HTR2BKCNH2
SCHEMBL7136536 0.84 HTR6 (0.78) HTR6HTR2BKCNH2
SCHEMBL7140464 0.84 HTR6 (0.64) HTR6
SCHEMBL12428286 0.84 HTR6 (1.00) HTR6
SCHEMBL12427316 0.83 HTR6 (0.75) HTR6HTR2BKCNH2
SCHEMBL12427106 0.83 HTR6 (1.00) HTR6HTR2BKCNH2
SCHEMBL13016762 0.83 HTR6 (0.77) HTR6HTR2BKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2351756-A1 SUBSTITUTED 3-ARYLSULFONYL-PYRAZOLO[1,5-A]PYRIMIDINES, SEROTONIN 5-HT6 RECEPTOR ANTAGONISTS AND METHODS FOR THE PRODUCTION AND USE THEREOF Ivashchenko, Andrey Alexandrovich (RU) 2011-08-03 EP disclosed
US-20110178078-A1 SUBSTITUTED 3-ARYLSULFONYL-PYRAZOLO[1,5-A]PYRIMIDINES, SEROTONIN 5-HT6 RECEPTOR ANTAGONISTS AND METHODS FOR THE PRODUCTION AND USE THEREOF IVASHCHENKO ANDREY ALEXANDROVICH 2011-07-21 US disclosed
WO-2010041983-A1 SUBSTITUTED 3-ARYLSULFONYL-PYRAZOLO[1,5-A]PYRIMIDINES, SEROTONIN 5-HT6 RECEPTOR ANTAGONISTS AND METHODS FOR THE PRODUCTION AND USE THEREOF АЛЛА ХЕМ, ЛЛС (US) 2010-04-15 WO 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-20110178078-A1 SUBSTITUTED 3-ARYLSULFONYL-PYRAZOLO[1,5-A]PYRIMIDINES, SEROTONIN 5-HT6 RECEPTOR ANTAGONISTS AND METHODS FOR THE PRODUCTION AND USE THEREOF HTR6, HTR1A, HTR3A HTR6 1/4885HTR2B 16/4885KCNH2 1689/4885

“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.