SCHEMBL2384843

SCHEMBL2384843

CCCCCCCCCC=CC=CC=CC=CC=CC(=O)OCCc1ccc(O)c(O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 6/20 0.54
▸ MAPT P10636 2/20 0.53
▸ HPGD P15428 2/20 0.53
▸ CYP1A2 P05177 2/20 0.53
▸ CYP3A4 P08684 2/20 0.53
▸ CYP2C9 P11712 2/20 0.53
▸ CYP2C19 P33261 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ GMNN O75496 1/20 0.53
▸ USP2 O75604 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ IDE P14735 1/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ THPO P40225 1/20 0.53
▸ MTOR P42345 1/20 0.53

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
SCHEMBL2385829 1.00 APP (0.54) APPMAPTHPGDCYP1A2CYP3A4
SCHEMBL2384841 1.00 APP (0.54) APPMAPTHPGDCYP1A2CYP3A4
SCHEMBL2385833 1.00 APP (0.54) APPMAPTHPGDCYP1A2CYP3A4
SCHEMBL2385804 0.87 MET (0.52) CYP3A4KDM4ELMNATP53HIF1A
SCHEMBL2386505 0.87 MET (0.52) CYP3A4KDM4ELMNATP53HIF1A
SCHEMBL2385802 0.87 MET (0.52) CYP3A4KDM4ELMNATP53HIF1A
SCHEMBL2386502 0.87 MET (0.52) CYP3A4KDM4ELMNATP53HIF1A
SCHEMBL2385754 0.85 LTA4H (0.48) APPCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL2383978 0.85 LTA4H (0.48) APPCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL2385757 0.85 LTA4H (0.48) APPCYP1A2CYP3A4CYP2C9CYP2C19

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
US-8465939-B2 Aging-related circulating particle-associated lipoprotein B oxidase (apoBNOX) and inhibitors thereof NOX TECHNOLOGIES, INC. (US) 2013-06-18 — — US disclosed
US-20110217401-A1 Aging-Related Circulating Particle-Associated Lipoprotein B Oxidase (apoBNOX) and Inhibitors Thereof NOX TECHNOLOGIES, INC. 2011-09-08 — — US disclosed
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