SCHEMBL7852293

SCHEMBL7852293

C=CCOc1cccc(CN2C(=O)CCc3c2cc(CC=C)c(O)c3CC=C)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
GAA P10253 1/20 0.35
EGLN1 Q9GZT9 1/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33

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
SCHEMBL7855653 0.84 POLB (0.36) EGLN1ALDH1A1LMNAPOLBMAPT
SCHEMBL7854244 0.81 MAPT (0.41) KDM4ENPC1RAB9AGAAALDH1A1
SCHEMBL7854334 0.78 PTGS1 (0.39) KDM4EGAAEGLN1ALDH1A1POLB
SCHEMBL7844774 0.77 PTGS1 (0.38) KDM4EGAAEGLN1ALDH1A1POLB
SCHEMBL7856424 0.77 ALDH1A1 (0.40) KDM4ENPC1RAB9AGAAEGLN1
SCHEMBL7844769 0.76 HDAC1 (0.37) EGLN1ALDH1A1LMNAPOLBHTT
SCHEMBL7854439 0.75 KDM4E (0.33) KDM4EGAAALDH1A1MAPTMEN1
SCHEMBL7845505 0.74 KDM4E (0.32) KDM4EGAAMAPT
SCHEMBL7853643 0.74 KDM4E (0.32) KDM4EGAA
SCHEMBL7852043 0.73 MEN1 (0.35) KDM4EGAAEGLN1ALDH1A1LMNA

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
CN-1084330-C Cydic amide derivatives OTSUKA PHARMA CO LTD (JP) 2002-05-08 CN claimed
EP-0719258-B1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMA CO LTD (JP) 2001-10-31 EP claimed
US-5786367-A OXYGEN SCAVENGERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US claimed
CN-1130377-A Cyclic amide derivatives OTSUKA PHARMA CO LTD (JP) 1996-09-04 CN claimed