SCHEMBL7086292

SCHEMBL7086292

CCOC(C)(OCC)OC(=O)/C=C\C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 11/20 0.53
TSHR P16473 2/20 0.35
TP53 P04637 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
EGLN3 Q9H6Z9 1/20 0.35
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ATM Q13315 1/20 0.31
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
ALOX15 P16050 1/20 0.30
RECQL P46063 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL7086300 1.00 HCAR2 (0.53) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL7088991 1.00 HCAR2 (0.53) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL7088989 0.92 HCAR2 (0.40) HCAR2ATMKEAP1NFE2L2
SCHEMBL7086291 0.92 HCAR2 (0.40) HCAR2ATMKEAP1NFE2L2
SCHEMBL7644479 0.85 HCAR2 (0.56) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL7644489 0.85 HCAR2 (0.56) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL7644005 0.80 HCAR2 (0.40) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL7644000 0.80 HCAR2 (0.40) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL1880532 0.78 HCAR2 (0.54) HCAR2TSHRTP53EGLN1EGLN3
Propane SCHEMBL7780510 0.78 HCAR2 (0.54) HCAR2TSHRTP53EGLN1EGLN3

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
CN-1281975-C Composition for optical material, optical material and plastic lens NOF CORP (JP) 2006-10-25 CN disclosed
CN-1461417-A Composition for optical material, optical material and plastic lens NOF CORP (JP) 2003-12-10 CN disclosed
EP-1331494-A1 COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND PLASTIC LENS NOF CORPORATION (JP) 2003-07-30 EP disclosed