SCHEMBL12427345

SCHEMBL12427345

Cc1nn2c(-c3ccccn3)ccnc2c1S(=O)(=O)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 12/20 0.55
MAPT P10636 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NTRK1 P04629 2/20 0.42
PIM1 P11309 2/20 0.42
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL12441540 0.85 HTR6 (0.77) HTR6
SCHEMBL12427317 0.85 HTR6 (0.69) HTR6
SCHEMBL12427109 0.72 HTR6 (0.69) HTR6
SCHEMBL12427500 0.72 HTR6 (0.84) HTR6
SCHEMBL12427026 0.71 HTR6 (1.00) HTR6
SCHEMBL12426991 0.71 HTR6 (0.76) HTR6
SCHEMBL12441533 0.68 HTR6 (0.78) HTR6
SCHEMBL12427014 0.68 HTR6 (0.69) HTR6
SCHEMBL13016786 0.68 HTR6 (1.00) HTR6SMN1; SMN2ALDH1A1KDM4E
SCHEMBL12427479 0.68 HTR6 (1.00) HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3020719-B1 SUBSTITUTED 3-ARYLSULFONYL-PYRAZOLO[1,5-A]PYRIMIDINES, SEROTONIN 5-HT6 RECEPTOR ANTAGONISTS AND METHODS FOR THE PRODUCTION AND USE THEREOF AND METHODS FOR THE PRODUCTION AND USE THEREOF ALLA CHEM LLC (US) 2017-09-20 EP 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