SCHEMBL7138403

SCHEMBL7138403

CCc1nn2c(N)cc(NCCN(C)C)nc2c1S(=O)(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.54
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL7133679 0.88 HTR6 (0.53) HTR6
SCHEMBL7136357 0.83 HTR6 (0.52) HTR6KDM4EMAPT
SCHEMBL7133477 0.82 HTR6 (0.76) HTR6
SCHEMBL7136309 0.81 HTR6 (0.50) HTR6
SCHEMBL7134457 0.78 HTR6 (0.52) HTR6
SCHEMBL7140118 0.74 HTR6 (0.48) HTR6
SCHEMBL7136754 0.72 HTR6 (0.62) HTR6KDM4EMAPT
SCHEMBL13043459 0.70 HTR6 (1.00) HTR6
SCHEMBL7141437 0.69 HTR6 (0.46) HTR6
SCHEMBL7142030 0.69 HTR6 (0.46) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0941994-B1 Pyrazolopyrimidines and pyrazolotriazines with 5-HT6 receptor affinity HOFFMANN LA ROCHE (CH) 2003-05-14 EP disclosed
US-6194410-B1 ANTISEROTONINE AGENTS; NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS HOFFMAN-LA ROCHE INC. 2001-02-27 US disclosed
EP-0941994-A1 Pyrazolopyrimidines and pyrazolotriazines with 5-HT6 receptor affinity F. HOFFMANN-LA ROCHE AG (CH) 1999-09-15 EP disclosed