SCHEMBL5738375

SCHEMBL5738375

CCCCCCCC/C=C/C/C=C/C/C=C/CCCC(=O)OCC

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.77
CYP3A4 P08684 3/20 0.77
ALOX15 P16050 3/20 0.77
HSD17B10 Q99714 3/20 0.77
TDP1 Q9NUW8 3/20 0.77
TSHR P16473 2/20 0.77
NR1I2 O75469 1/20 0.76
PGR P06401 1/20 0.76
ADORA3 P0DMS8 1/20 0.76
PTGS2 P35354 1/20 0.76
PDE4D Q08499 1/20 0.76
MGLL Q99685 1/20 0.72
MAPT P10636 3/20 0.70
CNR1 P21554 3/20 0.70
THRB P10828 1/20 0.70
FAAH O00519 3/20 0.65
PPARG P37231 3/20 0.62
HPGD P15428 3/20 0.62
KDM4E B2RXH2 2/20 0.62
LMNA P02545 2/20 0.62

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
SCHEMBL6810935 1.00 ALDH1A1 (0.77) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL5738380 1.00 ALDH1A1 (0.77) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL7796369 1.00 ALDH1A1 (0.77) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL24209 0.98 NR1I2 (0.78) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL24208 0.98 NR1I2 (0.78) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL4807962 0.98 NR1I2 (0.78) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL31264367 0.98 NR1I2 (0.78) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL20582487 0.98 NR1I2 (0.78) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL20582488 0.98 NR1I2 (0.78) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL6808635 0.97 ALDH1A1 (0.82) ALDH1A1CYP3A4ALOX15HSD17B10TDP1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436047-B2 Preventive or ameliorating agent for liver disease involving hepatopathy SUNTORY HOLDINGS LIMITED (JP) 2013-05-07 US disclosed
EP-1707198-B1 PREVENTIVE OR AMELIORATING AGENT FOR LIVER DISEASE INVOLVING HEPATOPATHY SUNTORY HOLDINGS LTD (JP) 2012-12-19 EP disclosed
CN-1842329-B Preventive or ameliorating agent for liver disease involving hepatopathy SUNTORY HOLDINGS LTD 2011-09-14 CN disclosed
EP-1707198-A1 PREVENTIVE OR AMELIORATING AGENT FOR LIVER DISEASE INVOLVING HEPATOPATHY SUNTORY LIMITED (JP) 2006-10-04 EP disclosed
CN-1842329-A Preventive or ameliorating agent for liver disease involving hepatopathy SUNTORY LTD (JP) 2006-10-04 CN disclosed
US-20060217442-A1 Preventive or ameliorating agent for liver disease involving hepatopathy SUNTORY LIMITED (JP) 2006-09-28 US disclosed
EP-0790056-B1 USE OF COMPOSITION FOR PREVENTING OR TREATING DISEASES CAUSED BY ABNORMALITIES IN CARTILAGE TISSUES SUNTORY LTD (JP) 2004-11-10 EP disclosed
US-6765020-B2 ADMINISTERING 6,9- OCTADECADIENOIC ACID, 8,11-EICOSADIENOIC ACID AND/OR 5,8,11- EICOSATRIENOIC ACID SUNTORY LIMITED (JP) 2004-07-20 US disclosed
US-20020012690-A1 DRUGS FOR PREVENTION AND TREATMENT OF DISEASES CAUSED BY ABNORMALITIES IN CARTILAGE TISSUES SUNTORY HOLDINGS LTD. (JP) 2002-01-31 US disclosed
EP-0790056-A1 PREVENTIVE OR REMEDY FOR DISEASES CAUSED BY ABNORMALITIES IN CARTILAGE TISSUES SUNTORY LIMITED (JP) 1997-08-20 EP disclosed