SCHEMBL7134694

SCHEMBL7134694

CSc1nn2c(N)cc(C)nc2c1S(=O)(=O)c1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.78
HTR2B P41595 1/20 0.60
KCNH2 Q12809 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
SCHEMBL7136586 0.91 HTR6 (0.65) HTR6
SCHEMBL7140098 0.90 HTR6 (0.64) HTR6
SCHEMBL7133543 0.89 HTR6 (0.62) HTR6HTR2BKCNH2
SCHEMBL7133521 0.88 HTR6 (0.79) HTR6
SCHEMBL7136296 0.88 HTR6 (0.79) HTR6
SCHEMBL7134594 0.88 HTR6 (0.62) HTR6HTR2BKCNH2
SCHEMBL7135422 0.88 HTR6 (0.62) HTR6HTR2BKCNH2
SCHEMBL3399354 0.88 HTR6 (1.00) HTR6HTR2B
SCHEMBL7135234 0.88 HTR6 (0.80) HTR6
SCHEMBL7140091 0.88 HTR6 (0.61) 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 7 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 claimed
US-6194410-B1 ANTISEROTONINE AGENTS; NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS HOFFMAN-LA ROCHE INC. 2001-02-27 US claimed
EP-0941994-A1 Pyrazolopyrimidines and pyrazolotriazines with 5-HT6 receptor affinity F. HOFFMANN-LA ROCHE AG (CH) 1999-09-15 EP claimed
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
JP-2000186090-A PYRAZOLOPYRIMIDINE AND PYRAZOLOTRIAZINE F HOFFMANN LA ROCHE AG 2000-07-04 JP disclosed
EP-0941994-A1 Pyrazolopyrimidines and pyrazolotriazines with 5-HT6 receptor affinity F. HOFFMANN-LA ROCHE AG (CH) 1999-09-15 EP disclosed