SCHEMBL13908166

SCHEMBL13908166

Cc1ccc(OCCOCCOC2(OCCOCCOc3ccc(C)cc3)CCCCC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.44
DRD4 P21917 6/20 0.44
DRD3 P35462 6/20 0.44
KDM4E B2RXH2 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HRH3 Q9Y5N1 1/20 0.39
RECQL P46063 1/20 0.38
ALDH1A1 P00352 1/20 0.36
HPGD P15428 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
SCHEMBL13908163 0.95 DRD2 (0.47) DRD2DRD4DRD3KDM4EL3MBTL1
SCHEMBL13908165 0.84 KCNA3 (0.44) DRD2DRD4DRD3KDM4EMEN1
SCHEMBL13908167 0.84 KCNA3 (0.44) DRD2DRD4DRD3KDM4EMEN1
SCHEMBL4239666 0.79 DRD2 (0.57) DRD2DRD4DRD3KDM4EL3MBTL1
SCHEMBL12570290 0.79 DRD2 (0.57) DRD2DRD4DRD3KDM4EL3MBTL1
SCHEMBL12570286 0.79 DRD2 (0.57) DRD2DRD4DRD3KDM4EL3MBTL1
SCHEMBL8675393 0.79 DRD2 (0.57) DRD2DRD4DRD3KDM4EL3MBTL1
SCHEMBL12570291 0.79 DRD2 (0.57) DRD2DRD4DRD3KDM4EL3MBTL1
SCHEMBL13908147 0.78 KCNA3 (0.48) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL15135779 0.78 HRH3 (0.52) KDM4EMEN1KMT2AHRH3ALDH1A1

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
US-20090075201-A1 PLANOGRAPHIC PRINTING PLATE MATERIAL, AND CYCLIC UREIDE MOIETY-CONTAINING PHENOLIC RESIN AND ITS SYNTHETIC PROCESS KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2009-03-19 US disclosed
US-20090075201-A1 PLANOGRAPHIC PRINTING PLATE MATERIAL, AND CYCLIC UREIDE MOIETY-CONTAINING PHENOLIC RESIN AND ITS SYNTHETIC PROCESS KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2009-03-19 US disclosed