SCHEMBL3855142

SCHEMBL3855142

CN(C)C1CCc2ccc(N)cc21

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.51
CHRNB2 P17787 1/20 0.41
CHRNA4 P43681 1/20 0.41
DRD1 P21728 1/20 0.39
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
TYK2 P29597 1/20 0.35
JAK3 P52333 1/20 0.35
SIGMAR1 Q99720 2/20 0.35
HTR6 P50406 2/20 0.35
GRIN2B Q13224 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34

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
SCHEMBL12549383 0.90 CHRNB2 (0.54) ACHECHRNB2CHRNA4DRD1
SCHEMBL15197529 0.86 ACHE (0.41) ACHECHRNB2CHRNA4DRD1MAOA
Hydrochloric Acid SCHEMBL15190647 0.84 ACHE (0.43) ACHECHRNB2CHRNA4DRD1MAOA
SCHEMBL6327093 0.79 MAOA (0.66) ACHEMAOAMAOB
SCHEMBL22547384 0.79 ACHE (0.51) ACHECHRNB2CHRNA4MAOAMAOB
SCHEMBL30896364 0.79 ACHE (0.51) ACHECHRNB2CHRNA4MAOAMAOB
SCHEMBL3645107 0.79 ACHE (0.51) ACHECHRNB2CHRNA4MAOAMAOB
SCHEMBL1576021 0.79 ACHE (0.51) ACHECHRNB2CHRNA4MAOAMAOB
SCHEMBL5390076 0.79 ACHE (0.55) ACHEMAOAMAOBDRD2DRD4
SCHEMBL10607673 0.76 ACHE (0.63) ACHEDRD2DRD3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009135927-A1 SUBSTITUTED N-PHENYL-2,3-DIHYDROIMIDAZO[2,1-B]THIAZOLE-5-SULFONAMIDE DERIVATIVES AS 5-HT6 LIGANDS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-11-12 WO claimed
WO-2009135925-A1 SUBSTITUTED N-IMIDAZO[2,1-B]THIAZOLE-5-SULFONAMIDE DERIVATIVES AS 5-HT6 LIGANDS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-11-12 WO claimed
EP-2116546-A1 Substituted N-phenyl-2,3-dihydroimidazo[2,1-b]thiazole-5-sulfonamide derivatives as 5-HT6 ligands Laboratorios Del. Dr. Esteve, S.A. (ES) 2009-11-11 EP claimed
EP-2116547-A1 Substituted N-imidazo(2, 1-b) thiazole-5-sulfonamide derivatives as 5-TH6 ligands Laboratorios Del. Dr. Esteve, S.A. (ES) 2009-11-11 EP claimed
EP-2116547-A1 Substituted N-imidazo(2, 1-b) thiazole-5-sulfonamide derivatives as 5-TH6 ligands Laboratorios Del. Dr. Esteve, S.A. (ES) 2009-11-11 EP disclosed
EP-2116546-A1 Substituted N-phenyl-2,3-dihydroimidazo[2,1-b]thiazole-5-sulfonamide derivatives as 5-HT6 ligands Laboratorios Del. Dr. Esteve, S.A. (ES) 2009-11-11 EP disclosed