SCHEMBL7086096

SCHEMBL7086096

O=C(O)Cc1cccc2c1OC(=O)CC2c1ccc2ccccc2c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.41
ALDH1A1 P00352 4/20 0.41
GAA P10253 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH2 P05091 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
MMP13 P45452 1/20 0.36

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
SCHEMBL7088729 0.82 HPGD (0.41) HPGDALDH1A1GAAHSD17B10MAPT
SCHEMBL7085894 0.77 HSD17B10 (0.38) HPGDALDH1A1GAAHSD17B10MAPT
SCHEMBL7087213 0.74 AKR1B1 (0.37) HPGDALDH1A1GAAHSD17B10MAPT
SCHEMBL7089716 0.72 AKR1B1 (0.34) HPGDMAPTTDP1
SCHEMBL11492038 0.72 KMT2A (0.67) HPGDALDH1A1GAAHSD17B10MAPT
SCHEMBL7083182 0.70 PTGDR2 (0.33) GAAMAPTTDP1
SCHEMBL880298 0.69 ALDH1A1 (0.51) HPGDALDH1A1GAAHSD17B10MAPT
SCHEMBL11701645 0.68 BRD4 (0.44) TDP1
SCHEMBL7086053 0.67 L3MBTL1 (0.36) HPGDALDH1A1HSD17B10MAPTMEN1
SCHEMBL880286 0.66 MAPT (0.56) HPGDALDH1A1GAAHSD17B10MAPT

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