SCHEMBL7083182

SCHEMBL7083182

O=C(O)Cc1cccc2c1OC(=O)CC2C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN5 P54829 1/20 0.33
PTPN11 Q06124 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
AKR1B1 P15121 1/20 0.33
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
PPARG P37231 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
MAPT P10636 1/20 0.31
GAA P10253 1/20 0.30
EPHX2 P34913 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
SCHEMBL7087213 0.78 AKR1B1 (0.37) DUSP3PTPN5PTPN11CTDSP1TDP1
SCHEMBL7089716 0.75 AKR1B1 (0.34) DUSP3PTPN5PTPN11CTDSP1TDP1
SCHEMBL7085894 0.73 HSD17B10 (0.38) DUSP3PTPN5PTPN11CTDSP1TDP1
SCHEMBL7086053 0.71 L3MBTL1 (0.36) TDP1MAPT
SCHEMBL7086096 0.70 HPGD (0.41) TDP1MAPTGAA
SCHEMBL2550680 0.67 PTGDR2 (0.56) PTGDR2TDP1AKR1B1EPHX2
SCHEMBL4969723 0.66 PTGDR2 (0.49) PTGDR2DUSP3PTPN5PTPN11CTDSP1
SCHEMBL3983073 0.66 PTGDR2 (0.49) PTGDR2DUSP3PTPN5PTPN11CTDSP1
SCHEMBL10587461 0.66 CFD (0.42) DUSP3PTPN5PTPN11CTDSP1TDP1
SCHEMBL12134260 0.66 TDP1 (0.39) TDP1KDM4EMAPTGAA

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
EP-1328262-A2 A METHOD TO INCORPORATE N-(4-HYDROXYPHENYL) RETINAMIDE IN LIPOSOMES Board of Regents, The University of Texas System (US) 2003-07-23 EP disclosed
WO-2002032413-A2 A METHOD TO INCORPORATE N-(4-HYDROXYPHENYL) RETINAMIDE IN LIPOSOMES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2002-04-25 WO disclosed