SCHEMBL5726850

SCHEMBL5726850

COc1cccc(-c2ccc(S(=O)(=O)Nc3cc4c(cc3OC)CCN(C)CC4)s2)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.52
HTR2C P28335 3/20 0.52
DRD3 P35462 3/20 0.52
HTR6 P50406 3/20 0.52
HTR2A P28223 2/20 0.52
GHSR Q92847 10/20 0.50
SLC2A1 P11166 1/20 0.46
TP53 P04637 2/20 0.46
POLB P06746 1/20 0.45
MAPK1 P28482 1/20 0.45
NLRP3 Q96P20 1/20 0.44
LMNA P02545 1/20 0.42
MAPT P10636 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
SCHEMBL5727521 0.91 DRD2 (0.58) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL5727922 0.90 DRD2 (0.59) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL5727546 0.90 GHSR (0.62) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL5727854 0.88 GHSR (0.52) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL5727550 0.86 DRD2 (0.71) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL5726744 0.86 DRD2 (0.57) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL5726862 0.86 HTR6 (0.54) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL5727648 0.85 DRD2 (0.57) DRD2HTR2CDRD3HTR6HTR2A
SCHEMBL6191883 0.84 GHSR (0.50) GHSRTP53POLBMAPK1NLRP3
SCHEMBL5726999 0.81 GHSR (0.55) DRD2HTR2CDRD3HTR6HTR2A

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-1549639-B1 SULPHONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LTD (GB) 2006-05-24 EP claimed
US-7122538-B2 Sulfonamide derivatives as antipsychotic agents GLAXO GROUP LIMITED (GB) 2006-10-17 US disclosed
EP-1549639-B1 SULPHONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LTD (GB) 2006-05-24 EP disclosed