SCHEMBL27490641

SCHEMBL27490641

[CH2]C(O)C1CCCN(CCS(C)(=O)=O)C1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.33
DRD2 P14416 3/20 0.32
DRD3 P35462 3/20 0.32
OPRM1 P35372 1/20 0.31
KDM4E B2RXH2 1/20 0.31
DRD1 P21728 1/20 0.31
DRD4 P21917 1/20 0.31
DRD5 P21918 1/20 0.31
CCR4 P51679 1/20 0.30

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
SCHEMBL25854093 0.83 HCRTR2 (0.35) DRD2DRD3CCR4
SCHEMBL27472793 0.81 CARM1 (0.33) DRD2KDM4E
SCHEMBL665189 0.77 DRD2 (0.34) BCHEDRD2DRD3OPRM1DRD1
SCHEMBL4373653 0.77 CYP2D6 (0.40) BCHEDRD2DRD3OPRM1
SCHEMBL7694113 0.77 DRD2 (0.31) BCHEDRD2DRD3DRD1DRD4
SCHEMBL666336 0.76 DRD2 (0.35) BCHEDRD2DRD3OPRM1DRD1
SCHEMBL27511929 0.76 CYP3A4 (0.37) BCHEDRD2DRD3KDM4E
SCHEMBL665211 0.76 DRD2 (0.33) BCHEDRD2DRD3OPRM1DRD1
SCHEMBL27491696 0.76 KDM2B (0.39) KDM4E
SCHEMBL4373649 0.75 CARM1 (0.35) BCHEDRD2DRD3OPRM1DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1161352-C Quinazoline derivatives 2004-08-11 CN claimed
CN-1322202-A Quinazoline derivatives ASTRA ZENECA N V (SE) 2001-11-14 CN claimed
CN-100360505-C Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2008-01-09 CN disclosed
CN-1597667-A Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2005-03-23 CN disclosed
CN-1161352-C Quinazoline derivatives 2004-08-11 CN disclosed
CN-1322202-A Quinazoline derivatives ASTRA ZENECA N V (SE) 2001-11-14 CN disclosed