SCHEMBL8085167

SCHEMBL8085167

CCOC(C(=O)O)C(C)CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
MME P08473 2/20 0.37
ACE P12821 2/20 0.37
CPA1 P15085 2/20 0.37
ACE2 Q9BYF1 2/20 0.37
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.33
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
TP53 P04637 1/20 0.32
THRB P10828 1/20 0.32
CA2 P00918 1/20 0.31
MAPK1 P28482 1/20 0.31
CHRM1 P11229 2/20 0.31

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
SCHEMBL26940426 1.00 ALDH1A1 (0.38) ALDH1A1MMEACECPA1ACE2
SCHEMBL387178 0.83 THRB (0.40) ALDH1A1MMP1MMP2MMP3MMP9
SCHEMBL1160265 0.83 THRB (0.40) ALDH1A1MMP1MMP2MMP3MMP9
SCHEMBL1196063 0.83 THRB (0.40) ALDH1A1MMP1MMP2MMP3MMP9
SCHEMBL8081881 0.83 ALDH1A1 (0.36) ALDH1A1MMEACECPA1ACE2
SCHEMBL9628984 0.81 MMP1 (0.48) MMP1MMP2MMP3MMP9MMP13
SCHEMBL26940409 0.81 MMP1 (0.48) MMP1MMP2MMP3MMP9MMP13
SCHEMBL6447692 0.81 ALDH1A1 (0.35) ALDH1A1MMEACECPA1ACE2
SCHEMBL8072261 0.79 ATM (0.39) ALDH1A1ACE2TP53CA2MAPK1
SCHEMBL7069046 0.79 LMNA (0.38) ACE2MMP1MMP2MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed