SCHEMBL7947328

SCHEMBL7947328

Nc1cccc(S(=O)(=O)n2cc(N3CCN4CCCC4C3)c3ncccc32)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.45
HTR6 P50406 8/20 0.44
ADCY5 O95622 1/20 0.40
KDM2B Q8NHM5 5/20 0.37
MAP4K4 O95819 1/20 0.36
HDAC4 P56524 1/20 0.35
CXCR4 P61073 2/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
DRD3 P35462 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
SCHEMBL3220703 0.89 HTR6 (0.44) HTR6KDM2B
SCHEMBL3223782 0.89 HTR6 (0.47) METHTR6KDM2B
SCHEMBL3214560 0.89 HTR6 (0.50) METHTR6DRD3
SCHEMBL3222864 0.89 MET (0.48) METHTR6KDM2B
SCHEMBL3216915 0.87 KDM2B (0.41) HTR6ADCY5KDM2B
SCHEMBL3218158 0.87 HTR6 (0.45) HTR6KDM2B
SCHEMBL3214442 0.87 HTR6 (0.46) METHTR6CHRM4
SCHEMBL3215703 0.86 HTR6 (0.54) METHTR6DRD3
SCHEMBL3218478 0.84 POLB (0.46) HTR6KDM2BCHRM1
SCHEMBL3221961 0.82 HTR6 (0.45) HTR6KDM2BCHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010021797-A1 CONDENSED HETEROCYCLIC COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-25 WO disclosed