SCHEMBL3670558

SCHEMBL3670558

CCCCCCCCSOC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.50
GMNN O75496 1/20 0.50
TP53 P04637 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
THRB P10828 1/20 0.50
CYP2C9 P11712 1/20 0.50
BLM P54132 1/20 0.50
CES2 O00748 3/20 0.45
GPR84 Q9NQS5 7/20 0.43
PPARG P37231 7/20 0.43
PPARD Q03181 7/20 0.43
PPARA Q07869 7/20 0.43
HDAC11 Q96DB2 5/20 0.43
TSHR P16473 4/20 0.43
PTPN1 P18031 3/20 0.43
ALDH1A1 P00352 2/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FABP4 P15090 2/20 0.43

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
SCHEMBL11260452 1.00 HSD17B10 (0.50) HSD17B10GMNNTP53POLBMAPT
SCHEMBL3206590 0.98 HSD17B10 (0.47) HSD17B10GMNNTP53POLBMAPT
SCHEMBL3635726 0.91
SCHEMBL7234137 0.83 CES2 (0.50) HSD17B10GMNNTP53POLBMAPT
SCHEMBL12482041 0.83 CES2 (0.50) HSD17B10GMNNTP53POLBMAPT
SCHEMBL9682707 0.83 CES2 (0.50) HSD17B10GMNNTP53POLBMAPT
SCHEMBL5621429 0.83 CES2 (0.50) HSD17B10GMNNTP53POLBMAPT
SCHEMBL9299729 0.81
SCHEMBL1994867 0.81 NAAA (0.50) HSD17B10GMNNTP53POLBMAPT
SCHEMBL3683266 0.81 NAAA (0.50) HSD17B10GMNNTP53POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1407854-A N-aryi-uracile-based herbicides BAYER AG (DE) 2003-04-02 CN claimed
EP-2180789-A2 IMPROVED PROCESSES FOR THE CONTROL OF UNDESIRED VEGETATION Gowan Co. (US) 2010-05-05 EP disclosed
WO-2010009005-A2 HERBICIDAL TREATMENT COMPOSITIONS AND METHODS FOR IMPROVED CONTROL OF UNDESIRED VEGETATION IN RICE CROPS GOWAN COMERCIO INTERNACIONAL E SERVICOS L (PT) 2010-01-21 WO disclosed
WO-2009015064-A2 IMPROVED PROCESSES FOR THE CONTROL OF UNDESIRED VEGETATION GOWAN CO. (US) 2009-01-29 WO disclosed