SCHEMBL513559

SCHEMBL513559

CCCCN(CCCC)c1ccc(-c2ccc(N(CCCC)CCCC)c(OC)c2)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GAK O14976 1/20 0.39
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
CRHR1 P34998 4/20 0.38
HTT P42858 1/20 0.37
SLC16A3 O15427 1/20 0.37
SLC16A1 P53985 1/20 0.37
ALOX5 P09917 1/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NOS1 P29475 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL1573613 0.79 CYP1A2 (0.47) ALDH1A1CYP3A4CRHR1ALOX5PTGS2
SCHEMBL12304301 0.78 SLC16A3 (0.44) ALDH1A1SLC16A3SLC16A1ALOX5PTGS2
SCHEMBL22474158 0.77 MAPT (0.41) ALDH1A1CYP3A4TSHRLMNACRHR1
SCHEMBL28482030 0.76 GAA (0.40) ALDH1A1TSHRTDP1LMNAHPGD
SCHEMBL12860226 0.76 CYP1A2 (0.44) ALDH1A1CYP3A4CRHR1ALOX5PTGS2
SCHEMBL2950313 0.76 SLC16A3 (0.48) ALDH1A1SLC16A3SLC16A1MEN1KMT2A
SCHEMBL21412638 0.75 PPARG (0.39) CYP3A4TSHRSLC16A3SLC16A1MEN1
SCHEMBL9810814 0.75 CA12 (0.46) ALDH1A1TSHRLMNACRHR1HTT
SCHEMBL29798308 0.74 PPARG (0.35) ALDH1A1TSHRLMNAHTTMEN1
SCHEMBL11923822 0.72 ALDH1A1 (0.47) ALDH1A1CYP3A4ALOX5PTGS2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200411933-A1 SOLUBLE OXYGEN EVOLVING CATALYSTS FOR RECHARGEABLE METAL-AIR BATTERIES LIOX POWER INC (US) 2020-12-31 US disclosed
EP-2561573-B1 SOLUBLE OXYGEN EVOLVING CATALYSTS FOR RECHARGEABLE METAL-AIR BATTERIES LIOX POWER INC (US) 2020-03-25 EP disclosed
EP-2561573-A1 SOLUBLE OXYGEN EVOLVING CATALYSTS FOR RECHARGEABLE METAL-AIR BATTERIES Liox Power, Inc. (US) 2013-02-27 EP disclosed
US-20120028137-A1 SOLUBLE OXYGEN EVOLVING CATALYSTS FOR RECHARGEABLE METAL-AIR BATTERIES LIOX POWER, INC. 2012-02-02 US disclosed
WO-2011133982-A1 SOLUBLE OXYGEN EVOLVING CATALYSTS FOR RECHARGEABLE METAL-AIR BATTERIES LIOX POWER, INC. (US) 2011-10-27 WO disclosed