SCHEMBL19674499

SCHEMBL19674499

CCCCOC(C)OC(CBr)c1ccc(OCc2ccccc2)c2[nH]c(=O)ccc12

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 13/20 0.35
DRD2 P14416 2/20 0.35
DRD1 P21728 2/20 0.35
DRD4 P21917 2/20 0.35
DRD3 P35462 2/20 0.35
PLA2G10 O15496 1/20 0.34
PLA2G2A P14555 1/20 0.34
ADORA3 P0DMS8 1/20 0.33
ADRB1 P08588 5/20 0.33
C5AR1 P21730 1/20 0.32

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
SCHEMBL18392985 1.00 ADRB2 (0.35) ADRB2DRD2DRD1DRD4DRD3
SCHEMBL19674488 0.91 ADRB2 (0.36) ADRB2DRD2DRD1DRD4DRD3
SCHEMBL18601882 0.91 ADRB2 (0.36) ADRB2DRD2DRD1DRD4DRD3
SCHEMBL15630094 0.91 ADRB2 (0.36) ADRB2DRD2DRD1DRD4DRD3
SCHEMBL18601868 0.87 ADRB2 (0.34) ADRB2DRD2DRD1DRD4DRD3
SCHEMBL16999077 0.86 ADORA3 (0.38) ADRB2DRD2DRD1DRD4DRD3
SCHEMBL14681026 0.80 ADORA3 (0.40) ADRB2DRD2DRD1DRD4DRD3
SCHEMBL27415356 0.79 ADORA3 (0.37) ADRB2DRD2DRD1DRD4DRD3
SCHEMBL384325 0.77 ADRB2 (0.39) ADRB2DRD2DRD1DRD4DRD3
SCHEMBL776314 0.77 ADRB2 (0.39) ADRB2DRD2DRD1DRD4DRD3

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-3138837-B1 INDACATEROL FREE BASE IN SOLID FORM CRYSTAL PHARMA SAU (ES) 2021-11-24 EP disclosed
EP-3848354-A1 PROCESS FOR THE PREPARATION OF INDACATEROL AND INTERMEDIATES THEREOF Crystal Pharma, S.A.U. (ES) 2021-07-14 EP disclosed
EP-2897937-B1 PROCESS FOR THE PREPARATION OF INDACATEROL AND INTERMEDIATES THEREOF CRYSTAL PHARMA SAU (ES) 2017-12-06 EP disclosed