SCHEMBL8215512

SCHEMBL8215512

[c]1ccc(C2CNCCO2)s1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.45
DRD3 P35462 1/20 0.45
HTR1A P08908 1/20 0.42
HTR2A P28223 1/20 0.38

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
SCHEMBL16031738 0.72 KCNH2 (0.31)
SCHEMBL7010502 0.72 DRD2 (0.47) DRD2DRD3HTR1AHTR2A
SCHEMBL188447 0.72 DRD2 (0.54) DRD2DRD3HTR1A
SCHEMBL30100996 0.70 DRD2 (0.45) DRD2DRD3HTR1AHTR2A
SCHEMBL1492682 0.70 DRD2 (0.56) DRD2DRD3HTR1A
SCHEMBL30100957 0.70 HTR1A (0.42) DRD2DRD3HTR1A
SCHEMBL31284382 0.70 DRD2 (0.45) DRD2DRD3HTR1A
SCHEMBL4536932 0.69 DRD2 (0.65) DRD2DRD3HTR1AHTR2A
SCHEMBL1626963 0.69 DRD2 (0.65) DRD2DRD3HTR1AHTR2A
SCHEMBL357358 0.69 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000023444-A1 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2000-04-27 WO claimed
WO-2000023444-A1 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2000-04-27 WO disclosed