SCHEMBL7142197

SCHEMBL7142197

CSc1nn2c(N3CCN(C)CC3)cc(C)nc2c1S(=O)(=O)c1cccs1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.55
HTR2B P41595 1/20 0.42

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
SCHEMBL7135401 0.91 HTR6 (0.55) HTR6HTR2B
SCHEMBL7140486 0.87 HTR6 (0.72) HTR6HTR2B
SCHEMBL7133534 0.85 HTR6 (0.60) HTR6
SCHEMBL7138422 0.83 HTR6 (0.56) HTR6HTR2B
SCHEMBL7140072 0.83 HTR6 (0.61) HTR6
SCHEMBL7140026 0.83 HTR6 (0.58) HTR6
SCHEMBL7137040 0.83 HTR6 (0.71) HTR6
SCHEMBL7133528 0.82 HTR6 (0.59) HTR6
SCHEMBL7141427 0.82 HTR6 (0.57) HTR6HTR2B
SCHEMBL7133683 0.82 HTR6 (0.56) 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