SCHEMBL7142965

SCHEMBL7142965

CNc1cc(C)nc2c(S(=O)(=O)c3ccccc3)c(SC)nn12

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.75
HTR2B P41595 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
SCHEMBL7138535 0.91 HTR6 (0.62) HTR6
SCHEMBL3399354 0.86 HTR6 (1.00) HTR6HTR2B
SCHEMBL12428377 0.85 HTR6 (1.00) HTR6HTR2B
SCHEMBL7134694 0.84 HTR6 (0.78) HTR6HTR2B
SCHEMBL7136536 0.84 HTR6 (0.78) HTR6HTR2B
SCHEMBL7138420 0.84 HTR6 (0.78) HTR6HTR2B
SCHEMBL7137101 0.84 HTR6 (0.75) HTR6
SCHEMBL13016762 0.83 HTR6 (0.77) HTR6HTR2B
SCHEMBL12428299 0.82 HTR6 (0.75) HTR6HTR2B
SCHEMBL12427021 0.82 HTR6 (0.75) HTR6HTR2B

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