SCHEMBL3407447

SCHEMBL3407447

[c]1cc(CC[C@H]2CNCCO2)ccn1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 13/20 0.36
SLC6A4 P31645 10/20 0.36
SLC6A3 Q01959 8/20 0.36
HTR2A P28223 3/20 0.36
ADRB2 P07550 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA1A P35348 1/20 0.36
HTR2B P41595 1/20 0.36
ADRA2C P18825 1/20 0.36

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
SCHEMBL1784565 1.00 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3HTR2AADRB2
SCHEMBL1481686 0.86 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3HTR2AADRB2
SCHEMBL1786507 0.78 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3HTR2AADRB2
SCHEMBL3427248 0.78 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3HTR2AADRB2
SCHEMBL78044 0.76 DRD4 (0.51) SLC6A2SLC6A4SLC6A3HTR2AADRB2
SCHEMBL8924483 0.76 DRD4 (0.51) SLC6A2SLC6A4SLC6A3HTR2AADRB2
SCHEMBL9432019 0.74 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3HTR2AADRB2
SCHEMBL6978725 0.73 GFER (0.44) SLC6A2SLC6A4SLC6A3HTR2AADRB2
SCHEMBL18689815 0.73 HRH1 (0.43) SLC6A2SLC6A4SLC6A3HTR2AADRB2
SCHEMBL21254392 0.73 DRD4 (0.52) SLC6A2SLC6A4SLC6A3

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-2252293-A2 KINASE INHIBITORS AND METHODS OF USE Intellikine, Inc. (US) 2010-11-24 EP disclosed
WO-2009114870-A2 KINASE INHIBITORS AND METHODS OF USE INTELLIKINE, INC. (US) 2009-09-17 WO disclosed
WO-2009114874-A2 BENZOTHIAZOLE KINASE INHIBITORS AND METHODS OF USE INTELLIKINE, INC. (US) 2009-09-17 WO disclosed