SCHEMBL7775646

SCHEMBL7775646

CN(C)S(=O)(=O)CCCCCCN1CCN(C(c2ccc(F)cc2)c2ccccn2)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 1/20 0.46
▸ IDH1 O75874 2/20 0.46
▸ DRD2 P14416 7/20 0.44
▸ DRD3 P35462 5/20 0.44
▸ DRD4 P21917 3/20 0.44
▸ HTR2A P28223 2/20 0.44
▸ HTR7 P34969 2/20 0.44
▸ ADRA1A P35348 3/20 0.42
▸ ADRA1B P35368 3/20 0.42
▸ SIGMAR1 Q99720 2/20 0.42
▸ ACHE P22303 3/20 0.41
▸ HTR1A P08908 2/20 0.41
▸ CHRM1 P11229 2/20 0.41
▸ ADRA1D P25100 2/20 0.41
▸ P2RX7 Q99572 1/20 0.41
▸ BACE1 P56817 1/20 0.41
▸ POLB P06746 1/20 0.40

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
Hydrochloric Acid SCHEMBL7775567 0.87 OPRD1 (0.49) OPRD1IDH1DRD2DRD3DRD4
SCHEMBL7773713 0.86 DRD2 (0.52) OPRD1IDH1DRD2DRD3DRD4
SCHEMBL7775644 0.86 P2RX7 (0.45) DRD2DRD3DRD4P2RX7
SCHEMBL7098292 0.81 DRD2 (0.42) OPRD1IDH1DRD2DRD3DRD4
Hydrochloric Acid SCHEMBL7775564 0.80 IDH1 (0.45) OPRD1IDH1DRD2DRD3DRD4
Hydrochloric Acid SCHEMBL7775562 0.80 IDH1 (0.44) OPRD1IDH1DRD2DRD3DRD4
SCHEMBL9255788 0.77 ACHE (0.52) OPRD1IDH1DRD2DRD3DRD4
SCHEMBL27342830 0.77 ACHE (0.52) OPRD1IDH1DRD2DRD3DRD4
SCHEMBL7097673 0.77 DRD3 (0.60) DRD2DRD3DRD4HTR2AHTR7
SCHEMBL7097689 0.77 DRD3 (0.60) DRD2DRD3DRD4HTR2AHTR7

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-0690051-B1 DIAZACYCLOALKANEALKYLSULFONAMIDE DERIVATIVE AZWELL INC (JP) 2001-07-18 — — EP disclosed
EP-0690051-A1 DIAZACYCLOALKANEALKYLSULFONAMIDE DERIVATIVE NIPPON SHOJI KABUSHIKI KAISHA (JP) 1996-01-03 — — EP disclosed
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