SCHEMBL28792767

SCHEMBL28792767

Cc1ccc(C2CNCCO2)cc1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.51
DRD3 P35462 1/20 0.51
HTR1A P08908 1/20 0.48
HTR2A P28223 1/20 0.46
SLC6A3 Q01959 1/20 0.46
KCNH2 Q12809 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46

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
SCHEMBL16292164 0.88 DRD2 (0.47) DRD2DRD3
SCHEMBL28792720 0.85 DRD2 (0.44) DRD2DRD3
SCHEMBL28792772 0.81 DRD2 (0.46) DRD2DRD3HTR1AHTR2ASLC6A3
SCHEMBL26021637 0.81 DRD2 (0.56) DRD2DRD3
SCHEMBL27606400 0.79 DRD2 (0.57) DRD2DRD3HTR1A
SCHEMBL27742412 0.77 DRD2 (0.60) DRD2DRD3HTR1A
SCHEMBL28792756 0.76 ADRA2C (0.45) DRD2HTR2ASLC6A3KCNH2
SCHEMBL27922480 0.76 DRD2 (0.46) DRD2DRD3SLC6A3KCNH2TAAR1
SCHEMBL4536932 0.76 DRD2 (0.65) DRD2DRD3HTR1AHTR2A
SCHEMBL1626963 0.76 DRD2 (0.65) DRD2DRD3HTR1AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114773253-A Preparation method of polysubstituted arylamine compound 大连理工大学 2022-07-22 CN disclosed