SCHEMBL19381997

SCHEMBL19381997

CNCc1c(C)nc2c(S(=O)(=O)c3ccccc3)c(NC)nn2c1C

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.80
HTR2B P41595 1/20 0.60

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
SCHEMBL12514327 0.89 HTR6 (0.74) HTR6HTR2B
SCHEMBL12427369 0.89 HTR6 (1.00) HTR6
SCHEMBL13383168 0.88 HTR6 (0.82) HTR6
SCHEMBL12426972 0.87 HTR6 (1.00) HTR6
SCHEMBL12427357 0.87 HTR6 (0.81) HTR6
SCHEMBL12426965 0.87 HTR6 (1.00) HTR6
SCHEMBL12427060 0.86 HTR6 (1.00) HTR6
SCHEMBL12427367 0.85 HTR6 (0.68) HTR6HTR2B
SCHEMBL12427163 0.85 HTR6 (0.78) HTR6
SCHEMBL12427165 0.85 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 1 patent. 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