SCHEMBL13238908

SCHEMBL13238908

CC(C)=CC1=C(C)C(=O)C(O)CC1(C)C

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.58
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
TSHR P16473 1/20 0.30
HIF1A Q16665 1/20 0.30
GMNN O75496 1/20 0.30
LMNA P02545 1/20 0.30
APEX1 P27695 1/20 0.30
PMP22 Q01453 1/20 0.30

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
SCHEMBL13382574 0.84 MAPT (0.43) MAPT
SCHEMBL23022360 0.82 MAPT (0.55) MAPTIDO1TDO2
SCHEMBL13265094 0.82 MAPT (0.55) MAPTIDO1TDO2
SCHEMBL14472687 0.81 MAPT (0.61) MAPTIDO1TDO2
SCHEMBL14495396 0.80 MAPT (0.68) MAPTIDO1TDO2TSHRHIF1A
SCHEMBL14495406 0.80 MAPT (0.68) MAPTIDO1TDO2TSHRHIF1A
SCHEMBL22140862 0.79 MAPT (0.75) MAPTTSHRHIF1AGMNNLMNA
SCHEMBL22984176 0.79 MAPT (0.75) MAPTTSHRHIF1AGMNNLMNA
SCHEMBL22107925 0.77 MAPT (0.57) MAPTIDO1TDO2
SCHEMBL14181277 0.77 MAPT (0.57) MAPTIDO1TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9180111-B2 Reduction in complement activation and inflammation during tissue injury by carotenoids, carotenoid analogs, or derivatives thereof CARDAX PHARMA, INC. (US) 2015-11-10 US disclosed
US-7763649-B2 Carotenoid analogs or derivatives for controlling connexin 43 expression CARDAX PHARMACEUTICALS, INC. (US) 2010-07-27 US disclosed
US-7723327-B2 Carotenoid ester analogs or derivatives for the inhibition and amelioration of liver disease CARDAX PHARMACEUTICALS, INC. (US) 2010-05-25 US disclosed
US-7691901-B2 Carotenoid analogs or derivatives for the inhibition and amelioration of inflammation CARDAX PHARMACEUTICALS INC. (US) 2010-04-06 US disclosed
US-7691901-B2 Carotenoid analogs or derivatives for the inhibition and amelioration of inflammation CARDAX PHARMACEUTICALS INC. (US) 2010-04-06 US disclosed
US-7592449-B2 Structural carotenoid analogs for the inhibition and amelioration of disease CARDAX PHARMACEUTICALS, INC. (US) 2009-09-22 US disclosed
US-7592449-B2 Structural carotenoid analogs for the inhibition and amelioration of disease CARDAX PHARMACEUTICALS, INC. (US) 2009-09-22 US disclosed
US-7521584-B2 Carotenoid analogs or derivatives for the inhibition and amelioration of disease CARDAX PHARMACEUTICALS, INC. (US) 2009-04-21 US disclosed
US-7521584-B2 Carotenoid analogs or derivatives for the inhibition and amelioration of disease CARDAX PHARMACEUTICALS, INC. (US) 2009-04-21 US disclosed
US-7375133-B2 Pharmaceutical compositions including carotenoid ether analogs or derivatives for the inhibition and amelioration of disease CARDAX PHARMACEUTICALS, INC. (US) 2008-05-20 US disclosed
US-7345091-B2 Carotenoid ether analogs or derivatives for the inhibition and amelioration of disease CARDAX PHARMACEUTICALS, INC. (US) 2008-03-18 US disclosed
US-7320997-B2 Pharmaceutical compositions including carotenoid ester analogs or derivatives for the inhibition and amelioration of disease CARDAX PHARMACEUTICALS, INC. (US) 2008-01-22 US disclosed
US-7317008-B2 Carotenoid ester analogs or derivatives for the inhibition and amelioration of ischemic reperfusion injury CARDAX PHARMACEUTICALS, INC. (US) 2008-01-08 US disclosed
US-7317008-B2 Carotenoid ester analogs or derivatives for the inhibition and amelioration of ischemic reperfusion injury CARDAX PHARMACEUTICALS, INC. (US) 2008-01-08 US disclosed