SCHEMBL3345708

SCHEMBL3345708

CCC(=O)N1CCOC(c2ccc(N)c(OC)c2)C1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 4/20 0.44
PDE4B Q07343 7/20 0.41
PIK3CD O00329 4/20 0.40
PIK3CA P42336 3/20 0.39
EPHA2 P29317 1/20 0.38
KDR P35968 1/20 0.38
HTR4 Q13639 1/20 0.38
HTT P42858 1/20 0.37
QDPR P09417 1/20 0.37

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
SCHEMBL19002794 0.81 DRD3 (0.47) DRD3
SCHEMBL4779850 0.80 DRD3 (0.55) DRD3
SCHEMBL13362111 0.80 QDPR (0.55) PDE4BQDPR
SCHEMBL2957074 0.80 DRD3 (0.49) DRD3HTR4QDPR
SCHEMBL19002671 0.80 DRD3 (0.46) DRD3HTT
SCHEMBL28807580 0.76 EPHX2 (0.43) DRD3HTT
SCHEMBL19002796 0.76 EPHX2 (0.43) DRD3
SCHEMBL19002793 0.76 MEN1 (0.46) DRD3
SCHEMBL14035660 0.76 USP30 (0.51) DRD3HTT
SCHEMBL19002798 0.75 DRD3 (0.65) DRD3

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
WO-2010049731-A1 PYRAZOLO- AND IMIDAZOPYRIDINYLPYRIMIDINEAMINES AS IGF-1R TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2010-05-06 WO disclosed