SCHEMBL16693303

SCHEMBL16693303

C=C(C)C(=O)OCc1cccc(/N=N/c2cc(C(=O)c3ccccc3)c(O)cc2OCC)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.40
HPGD P15428 4/20 0.40
MAPT P10636 4/20 0.40
KDM4E B2RXH2 2/20 0.40
RECQL P46063 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP3A4 P08684 1/20 0.40
MRGPRX4 Q96LA9 2/20 0.40
PDE5A O76074 8/20 0.36
ALDH1A1 P00352 3/20 0.35
KMT2A Q03164 3/20 0.35
TP53 P04637 1/20 0.34
PKM P14618 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 1/20 0.34
PGR P06401 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL16693248 0.91 HPGD (0.42) LMNAHPGDMAPTKDM4ERECQL
SCHEMBL16693302 0.91 MAPT (0.49) LMNAHPGDMAPTKDM4ERECQL
SCHEMBL16693268 0.89 HPGD (0.36) LMNAHPGDMAPTKDM4ERECQL
SCHEMBL16693329 0.89 MAPT (0.40) LMNAHPGDMAPTKDM4ERECQL
SCHEMBL16693234 0.87 LMNA (0.38) LMNAHPGDMAPTKDM4ERECQL
SCHEMBL16693249 0.84 LMNA (0.38) LMNAHPGDMAPTKDM4ERECQL
SCHEMBL16693320 0.84 PTGES (0.40) LMNAHPGDMAPTKDM4ERECQL
SCHEMBL16693258 0.84 GAA (0.37) LMNAHPGDMAPTKDM4ERECQL
SCHEMBL16693285 0.82 MAPT (0.38) LMNAHPGDMAPTKDM4ERECQL
SCHEMBL16693264 0.82 MAPT (0.51) LMNAHPGDMAPTKDM4ERECQL

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