SCHEMBL3389844

SCHEMBL3389844

CCCCCCCCCCCCCSCC1CO1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
TDP1 Q9NUW8 1/20 0.46
EPHX1 P07099 1/20 0.41
CES2 O00748 3/20 0.39
GMNN O75496 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
CYP2C9 P11712 1/20 0.39
BLM P54132 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CA2 P00918 1/20 0.38
GBA1 P04062 2/20 0.38
GBA3 Q9H227 1/20 0.38
TBXA2R P21731 2/20 0.35
FAAH O00519 4/20 0.35
CES1 P23141 4/20 0.35
PLA2G6 O60733 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
SCHEMBL3389425 1.00 ALDH1A1 (0.54) ALDH1A1TDP1EPHX1CES2GMNN
SCHEMBL3392961 1.00 ALDH1A1 (0.54) ALDH1A1TDP1EPHX1CES2GMNN
SCHEMBL3393524 1.00 ALDH1A1 (0.54) ALDH1A1TDP1EPHX1CES2GMNN
SCHEMBL3391102 1.00 ALDH1A1 (0.54) ALDH1A1TDP1EPHX1CES2GMNN
SCHEMBL3392573 1.00 ALDH1A1 (0.54) ALDH1A1TDP1EPHX1CES2GMNN
SCHEMBL3390339 1.00 ALDH1A1 (0.54) ALDH1A1TDP1EPHX1CES2GMNN
SCHEMBL3391093 1.00 ALDH1A1 (0.54) ALDH1A1TDP1EPHX1CES2GMNN
SCHEMBL3388982 1.00 ALDH1A1 (0.54) ALDH1A1TDP1EPHX1CES2GMNN
SCHEMBL3392889 1.00 ALDH1A1 (0.54) ALDH1A1TDP1EPHX1CES2GMNN
SCHEMBL3393759 1.00 ALDH1A1 (0.54) ALDH1A1TDP1EPHX1CES2GMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7112558-B2 Lubricant composition containing phosphorous, molybdenum, and hydroxy-substituted dithiocarbamates AFTON CHEMICAL INTANGIBLES LLC (US) 2006-09-26 US claimed
US-20030211951-A1 Lubricant composition containing phosphorous, molybdenum, and hydroxy-substituted dithiocarbamates AFTON CHEMICAL INTANGIBLES LLC 2003-11-13 US claimed
CN-1443834-A Lubricating oil composite containing phosphorus, molybdenum and hydroxyl substituted dithiocarbamate ETHYL CO (US) 2003-09-24 CN claimed
EP-1338590-B1 Lubricant composition containing phosphorus, molybdenum and hydroxy-substituted dithiocarbamates ETHYL CORP (US) 2010-12-22 EP disclosed
CN-100519713-C Lubricating oil composite containing phosphorus, molybdenum and hydroxyl substituted dithiocarbamate ETHYL CORP (US) 2009-07-29 CN disclosed
US-7112558-B2 Lubricant composition containing phosphorous, molybdenum, and hydroxy-substituted dithiocarbamates AFTON CHEMICAL INTANGIBLES LLC (US) 2006-09-26 US disclosed
US-20030211951-A1 Lubricant composition containing phosphorous, molybdenum, and hydroxy-substituted dithiocarbamates AFTON CHEMICAL INTANGIBLES LLC 2003-11-13 US disclosed
CN-1443834-A Lubricating oil composite containing phosphorus, molybdenum and hydroxyl substituted dithiocarbamate ETHYL CO (US) 2003-09-24 CN disclosed
EP-1338590-A1 Lubricant composition containing phosphorus, molybdenum and hydroxy-substituted dithiocarbamates ETHYL CORPORATION (US) 2003-08-27 EP disclosed