SCHEMBL2249258

SCHEMBL2249258

CCCCCS(=O)(=O)c1cnn2c(Cl)ccnc12

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 11/20 0.37
GSR P00390 1/20 0.35
TXNRD1 Q16881 1/20 0.35
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GPR119 Q8TDV5 4/20 0.33
ALDH1A1 P00352 2/20 0.33
PKM P14618 1/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL2322469 0.82 THRB (0.34) THRBHPGDKDM4EALOX5APFEN1
SCHEMBL2245083 0.74 SMPD3 (0.42) HPGDKDM4EALDH1A1
SCHEMBL3433516 0.70 KDM4E (0.54) HPGDKDM4EALDH1A1PKMMEN1
SCHEMBL1193836 0.69 HTR6 (0.36) THRB
SCHEMBL2319946 0.68 ALOX5AP (0.35) HPGDKDM4EALDH1A1ALOX5APFEN1
SCHEMBL23104339 0.66 KDM4E (0.56) HPGDKDM4EGPR119ALDH1A1MEN1
SCHEMBL2314828 0.65 THRB (0.32) THRBGSRTXNRD1
SCHEMBL2359117 0.64 KDM4E (0.34) THRBGSRTXNRD1KDM4EALDH1A1
SCHEMBL17743608 0.64 KDM4E (0.34) GSRTXNRD1HPGDKDM4EALOX5AP
SCHEMBL10389512 0.64 KMT2A (0.46) THRBGSRTXNRD1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3020719-A1 SUBSTITUTED 3-ARYLSULFONYL-PYRAZOLO[1,5-A]PYRIMIDINES, SEROTONIN 5-HT6 RECEPTOR ANTAGONISTS AND METHODS FOR THE PRODUCTION AND USE THEREOFAND METHODS FOR THE PRODUCTION AND USE THEREOF Alla Chem, LLC. (US) 2016-05-18 EP disclosed
US-8618114-B2 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) 2013-12-31 US disclosed
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

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 THRB 711/4885GSR 913/4885TXNRD1 1606/4885

“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.