SCHEMBL7087213

SCHEMBL7087213

CC1CC(=O)Oc2c(CC(=O)O)cccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
DUSP3 P51452 1/20 0.36
PTPN5 P54829 1/20 0.36
PTPN11 Q06124 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
HPGD P15428 4/20 0.35
GLA P06280 1/20 0.35
STING1 Q86WV6 1/20 0.35
PTGS2 P35354 3/20 0.34
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33

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
SCHEMBL7089716 0.80 AKR1B1 (0.34) AKR1B1TDP1DUSP3PTPN5PTPN11
SCHEMBL7083182 0.78 PTGDR2 (0.33) AKR1B1TDP1DUSP3PTPN5PTPN11
SCHEMBL7085894 0.78 HSD17B10 (0.38) AKR1B1TDP1DUSP3PTPN5PTPN11
SCHEMBL7156303 0.78 HPGD (0.35) TDP1HPGDALDH1A1MEN1MAPT
SCHEMBL7086053 0.75 L3MBTL1 (0.36) TDP1HPGDALDH1A1MEN1MAPT
SCHEMBL7086096 0.74 HPGD (0.41) TDP1HPGDALDH1A1MEN1MAPT
SCHEMBL13620480 0.74 HPGD (0.50) TDP1HPGDALDH1A1MEN1MAPT
SCHEMBL28940452 0.71 MAPT (0.47) HPGDALDH1A1MEN1MAPTKMT2A
SCHEMBL7087461 0.67 EDNRA (0.35) AKR1B1TDP1DUSP3PTPN5PTPN11
SCHEMBL7082800 0.67 AKR1B1 (0.37) AKR1B1TDP1DUSP3PTPN5PTPN11

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