SCHEMBL2565664

SCHEMBL2565664

COC(=O)C(C)CCCC(=O)C(=O)CCCCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ALDH1A1 P00352 2/20 0.41
FFAR4 Q5NUL3 1/20 0.41
FFAR1 O14842 1/20 0.41
CYP1A2 P05177 1/20 0.39
LMNA P02545 2/20 0.39
GSTK1 Q9Y2Q3 2/20 0.39
NFKB1 P19838 1/20 0.38
PMP22 Q01453 1/20 0.38
PLA2G10 O15496 1/20 0.38
AKR1B1 P15121 1/20 0.38
PLA2G2A P14555 1/20 0.37
PLA2G4A P47712 1/20 0.37
SLC22A6 Q4U2R8 1/20 0.36
SLC22A8 Q8TCC7 1/20 0.36
GPR84 Q9NQS5 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL710385 0.93 TSHR (0.48) TSHRALDH1A1FFAR4FFAR1CYP1A2
SCHEMBL4372390 0.91 FFAR4 (0.48) TSHRALDH1A1FFAR4FFAR1CYP1A2
Hydrochloric Acid SCHEMBL6941524 0.89 FFAR4 (0.47) TSHRALDH1A1FFAR4FFAR1CYP1A2
SCHEMBL14809588 0.89 FFAR4 (0.52) TSHRALDH1A1FFAR4FFAR1LMNA
SCHEMBL14809191 0.89 FFAR4 (0.52) TSHRALDH1A1FFAR4FFAR1LMNA
SCHEMBL14809779 0.89 FFAR4 (0.52) TSHRALDH1A1FFAR4FFAR1LMNA
SCHEMBL8762617 0.89 FFAR4 (0.52) TSHRALDH1A1FFAR4FFAR1LMNA
SCHEMBL14809859 0.89 FFAR4 (0.52) TSHRALDH1A1FFAR4FFAR1LMNA
SCHEMBL14809983 0.89 FFAR4 (0.52) TSHRALDH1A1FFAR4FFAR1LMNA
SCHEMBL4993309 0.89 FFAR4 (0.52) TSHRALDH1A1FFAR4FFAR1LMNA

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
EP-2038341-B1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP ASSETS BV (NL) 2011-11-02 EP disclosed
US-20100130695-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP ASSETS B.V. (NL) 2010-05-27 US disclosed
EP-2038341-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSMIP Assets B.V. (NL) 2009-03-25 EP disclosed
WO-2008006493-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP ASSETS B.V. (NL) 2008-01-17 WO disclosed