SCHEMBL16693302

SCHEMBL16693302

C=C(C)C(=O)OCc1cccc(/N=N/c2cc(C(=O)c3ccccc3)c(O)cc2OC)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
LMNA P02545 5/20 0.49
HPGD P15428 3/20 0.49
KDM4E B2RXH2 2/20 0.49
HSD17B10 Q99714 2/20 0.49
CYP3A4 P08684 1/20 0.49
RECQL P46063 1/20 0.49
KMT2A Q03164 6/20 0.42
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 4/20 0.39
NPSR1 Q6W5P4 2/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPK1 P28482 3/20 0.39
HTT P42858 2/20 0.39
CYP1A2 P05177 1/20 0.39
PGR P06401 1/20 0.39
CYP2D6 P10635 1/20 0.39
SLC6A2 P23975 1/20 0.39
PDE4A P27815 1/20 0.39

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
SCHEMBL16693303 0.91 LMNA (0.40) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL16693264 0.91 MAPT (0.51) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL16693329 0.91 MAPT (0.40) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL16693257 0.89 MAPT (0.43) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL16693299 0.86 MAPT (0.46) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL16693320 0.86 PTGES (0.40) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL16693224 0.84 MAPT (0.47) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL16693259 0.84 MAPT (0.43) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL16693230 0.82 MAPT (0.47) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL16693248 0.82 HPGD (0.42) MAPTLMNAHPGDKDM4EHSD17B10

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
WO-2015064674-A1 METHOD FOR MANUFACTURING POLYMERIZABLE UV-ABSORBING DYE 興和株式会社 2015-05-07 WO disclosed
US-8629263-B2 Nucleoside phosphoramidates GILEAD PHARMASSET LLC (US) 2014-01-14 US disclosed