SCHEMBL2548829

SCHEMBL2548829

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.48
HIF1A Q16665 2/20 0.48
CYP2D6 P10635 1/20 0.48
TSHR P16473 1/20 0.48
ALDH1A1 P00352 1/20 0.43
HMGCR P04035 1/20 0.43
CHRM1 P11229 1/20 0.43
TBXA2R P21731 1/20 0.43
ADRA1A P35348 1/20 0.43
CPT2 P23786 2/20 0.37
KDM4E B2RXH2 2/20 0.37
FFAR1 O14842 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ACLY P53396 3/20 0.36
FFAR3 O14843 1/20 0.33
LMNA P02545 1/20 0.33
SLC15A2 Q16348 1/20 0.33
KDM6B O15054 1/20 0.33
KDM5C P41229 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33

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
SCHEMBL23126 0.82 ALDH1A1 (0.53) CYP2C19HIF1ACYP2D6TSHRALDH1A1
SCHEMBL11436629 0.79 ALDH1A1 (0.50) CYP2C19HIF1ACYP2D6TSHRALDH1A1
SCHEMBL17818674 0.79 ALDH1A1 (0.50) CYP2C19HIF1ACYP2D6TSHRALDH1A1
SCHEMBL27930574 0.75 HMGCR (0.37) CYP2C19HIF1ACYP2D6TSHRALDH1A1
SCHEMBL7684976 0.74 ALDH1A1 (0.35) CYP2C19HIF1ACYP2D6TSHRALDH1A1
SCHEMBL10345101 0.74 ALDH1A1 (0.35) CYP2C19HIF1ACYP2D6TSHRALDH1A1
SCHEMBL4759426 0.74 ALDH1A1 (0.45) CYP2C19HIF1ACYP2D6TSHRALDH1A1
SCHEMBL7770808 0.72 CYP2C19 (0.48) CYP2C19HIF1ACYP2D6TSHRALDH1A1
SCHEMBL27727275 0.72 ALDH1A1 (0.33) CYP2C19HIF1ACYP2D6TSHRALDH1A1
SCHEMBL27589221 0.72 ALDH1A1 (0.33) CYP2C19HIF1ACYP2D6TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109096261-A A kind of preparation method of Fimasartan 四川海思科制药有限公司 2018-12-28 CN claimed
CN-103119208-A A biocidal polyolefin yarn with 3-12 filaments VESTERGAARD FRANDSEN SA 2013-05-22 CN claimed
WO-2011124228-A1 A BIOCIDAL POLYOLEFIN YARN WITH 3-12 FILAMENTS VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO claimed
WO-2011124227-A1 BIOCIDAL ACID-ADJUSTED POLYMER WITH POLYPROPYLENE VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO claimed
CN-106380729-B Novel PVC heat stabilizer 邵卫东 2019-01-29 CN disclosed
CN-109096261-A A kind of preparation method of Fimasartan 四川海思科制药有限公司 2018-12-28 CN disclosed
CN-109096261-A A kind of preparation method of Fimasartan 四川海思科制药有限公司 2018-12-28 CN disclosed
CN-107973784-A Synthesis method of fimasartan 珠海市海瑞德生物科技有限公司 2018-05-01 CN disclosed
CN-106380729-A Novel PVC heat stablizer 邵卫东 2017-02-08 CN disclosed
CN-103119208-A A biocidal polyolefin yarn with 3-12 filaments VESTERGAARD FRANDSEN SA 2013-05-22 CN disclosed
WO-2011124227-A1 BIOCIDAL ACID-ADJUSTED POLYMER WITH POLYPROPYLENE VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO disclosed
WO-2011124228-A1 A BIOCIDAL POLYOLEFIN YARN WITH 3-12 FILAMENTS VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO disclosed
CN-1290501-C Pharmaceutically active isoindoline derivatives CELGENE CORP (US) 2006-12-20 CN disclosed
CN-1575174-A Pharmaceutically active isoindoline derivatives CELGENE CORP (US) 2005-02-02 CN disclosed
CN-1295565-A Barbituric acid derivative and preventive and therapeutic agent for bone and cartilage containing the same HOECHST MARION ROUSSEL INC (FR) 2001-05-16 CN disclosed
CN-1055617-C Oral medicament form MERCK PATENT GMBH (DE) 2000-08-23 CN disclosed
CN-1090171-A Oral Pharmaceutical dosage forms MERCK PATENT GMBH (DE) 1994-08-03 CN disclosed
US-4382972-A Flavoring compositions and flavored comestibles containing alkyl 2,3-dihydro-3(1'-hydroxyalkylidene)-2-oxo-5-alkylfuran-4-carboxylates FRITZSCHE DODGE & OLCOTT INC. (US) 1983-05-10 US disclosed