SCHEMBL6336594

SCHEMBL6336594

C=C(C)C(=O)OCCOC(=O)C=Cc1ccc(OC)c(OC)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.67
FDPS P14324 3/20 0.60
APP P05067 1/20 0.60
KDM4E B2RXH2 3/20 0.58
ALDH1A1 P00352 3/20 0.58
MAPT P10636 2/20 0.58
MET P08581 7/20 0.57
NFE2L2 Q16236 1/20 0.57
CA12 O43570 1/20 0.55
CA4 P22748 1/20 0.55
CA6 P23280 1/20 0.55
HTR7 P34969 1/20 0.55
CA5A P35218 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
CA5B Q9Y2D0 1/20 0.55
HPGD P15428 1/20 0.55
ALOX15 P16050 1/20 0.55
MAPK1 P28482 1/20 0.55

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
SCHEMBL6336598 1.00 TTR (0.67) TTRFDPSAPPKDM4EALDH1A1
SCHEMBL4710319 0.95 TTR (0.61) TTRFDPSAPPKDM4EALDH1A1
SCHEMBL4710316 0.95 TTR (0.61) TTRFDPSAPPKDM4EALDH1A1
SCHEMBL8147030 0.95 TTR (0.61) TTRFDPSAPPKDM4EALDH1A1
SCHEMBL8147027 0.95 TTR (0.61) TTRFDPSAPPKDM4EALDH1A1
SCHEMBL4623641 0.94 TTR (0.60) TTRFDPSAPPKDM4EALDH1A1
SCHEMBL7252140 0.94 TTR (0.60) TTRFDPSAPPKDM4EALDH1A1
SCHEMBL7252510 0.94 TTR (0.60) TTRFDPSAPPKDM4EALDH1A1
SCHEMBL7246945 0.94 TTR (0.60) TTRFDPSAPPKDM4EALDH1A1
SCHEMBL7252807 0.94 TTR (0.60) TTRFDPSAPPKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050202096-A1 Microcapsules for encapsulation of bioactive substances AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2005-09-15 US claimed
US-20050202096-A1 Microcapsules for encapsulation of bioactive substances AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2005-09-15 US disclosed
US-RE36625-E Linear and cyclic polymers or oligomers having a photoreactive ethene group ROLIC AG (CH) 2000-03-21 US disclosed
US-5539074-A LIQUID CRYSTAL POLYMERS ON SILICA FOR LIGHT SENSITIVE ELEMENTS HOFFMANN-LA ROCHE INC. (US) 1996-07-23 US disclosed