SCHEMBL3624153

SCHEMBL3624153

CC1CC(c2cn(S(=O)(=O)c3ccc4c(cnn4C)c3)c3cccnc23)=CCN1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 17/20 0.43
HTR1A P08908 3/20 0.43
DRD2 P14416 3/20 0.43
HTR2A P28223 3/20 0.43
HTR7 P34969 3/20 0.43
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 1/20 0.40
DRD3 P35462 1/20 0.40
GRM4 Q14833 1/20 0.37
CHRM1 P11229 1/20 0.36
GLRA3 O75311 1/20 0.35
GLRB P48167 1/20 0.35

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
SCHEMBL3621695 0.84 HTR6 (0.42) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL3621648 0.82 HTR6 (0.39) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL3611501 0.81 HTR6 (0.56) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL3623951 0.80 PKM (0.41) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL3625114 0.78 NR3C2 (0.44) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL3624061 0.76 AKR1C3 (0.46) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL3621753 0.72 HTR6 (0.61) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL3617687 0.70 HTR6 (0.35) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL13953734 0.67 HTR6 (0.61) HTR6HTR1ADRD2HTR2AHTR7
SCHEMBL3622224 0.67 HTR6 (0.58) HTR6HTR1ADRD2HTR2AHTR7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2184990-A2 3' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY Memory Pharmaceuticals Corporation (US) 2010-05-19 EP claimed
WO-2009023844-A2 3' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2009-02-19 WO claimed