SCHEMBL14360772

SCHEMBL14360772

CCC(CCCCCC(=O)O)CCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTK1 Q9Y2Q3 2/20 0.57
FFAR4 Q5NUL3 2/20 0.55
FFAR1 O14842 2/20 0.55
ALDH1A1 P00352 3/20 0.53
GPR84 Q9NQS5 7/20 0.52
PPARG P37231 7/20 0.52
PPARD Q03181 7/20 0.52
PPARA Q07869 7/20 0.52
HDAC11 Q96DB2 5/20 0.52
TSHR P16473 5/20 0.52
PTPN1 P18031 3/20 0.52
TLR2 O60603 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
FABP4 P15090 2/20 0.52
SLC22A6 Q4U2R8 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
MEN1 O00255 1/20 0.52
ESR1 P03372 1/20 0.52
ALOX15 P16050 1/20 0.52
PDE4A P27815 1/20 0.52

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
SCHEMBL28662084 1.00 GSTK1 (0.57) GSTK1FFAR4FFAR1ALDH1A1GPR84
SCHEMBL9436291 1.00 GSTK1 (0.57) GSTK1FFAR4FFAR1ALDH1A1GPR84
SCHEMBL14777940 1.00 GSTK1 (0.57) GSTK1FFAR4FFAR1ALDH1A1GPR84
SCHEMBL14809946 1.00 GSTK1 (0.57) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809188 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809858 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809564 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809039 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809576 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84
Hydrochloric Acid SCHEMBL14809667 0.98 GSTK1 (0.55) GSTK1FFAR4FFAR1ALDH1A1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110099990-B Perfume mixture 西姆莱斯股份公司 2022-11-29 CN disclosed
CN-115322833-A Perfume mixture 西姆莱斯股份公司 2022-11-11 CN disclosed
CN-108026066-B Pyridine compounds useful for combating phytopathogenic fungi 巴斯夫欧洲公司 2022-05-31 CN disclosed
US-9340691-B2 Hot melt ink composition comprising a copolyester and process for preparing a copolyester OCE-TECHNOLOGIES B.V. (NL) 2016-05-17 US disclosed
EP-2596960-B1 Reusable print medium and method of manufacturing thereof OCE TECH BV (NL) 2016-04-20 EP disclosed
US-8809432-B2 Reusable print medium and method of manufacturing thereof OCE TECHNOLOGIES B.V. (NL) 2014-08-19 US disclosed
EP-2726564-A2 HOT MELT INK COMPOSITION COMPRISING A COPOLYESTER AND PROCESS FOR PREPARING A COPOLYESTER OCE-Technologies B.V. (NL) 2014-05-07 EP disclosed
US-20140114013-A1 HOT MELT INK COMPOSITION COMPRISING A COPOLYESTER AND PROCESS FOR PREPARING A COPOLYESTER OCE-TECHNOLOGIES B.V. (NL) 2014-04-24 US disclosed
US-20130137805-A1 REUSABLE PRINT MEDIUM AND METHOD OF MANUFACTURING THEREOF OCE TECHNOLOGIES B.V. (NL) 2013-05-30 US disclosed
EP-2596960-A2 Reusable print medium and method of manufacturing thereof Océ-Technologies B.V. (NL) 2013-05-29 EP disclosed
WO-2013000761-A2 HOT MELT INK COMPOSITION COMPRISING A COPOLYESTER AND PROCESS FOR PREPARING A COPOLYESTER OCE-TECHNOLOGIES B.V. (NL) 2013-01-03 WO disclosed