SCHEMBL7052204

SCHEMBL7052204

CCCCCC(=O)OC(O)(O)CC

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.50
LMNA P02545 3/20 0.47
PAM P19021 2/20 0.46
CES2 O00748 4/20 0.44
CES1 P23141 4/20 0.44
MAPT P10636 2/20 0.44
MAPK1 P28482 1/20 0.44
TSHR P16473 2/20 0.43
AKR1B1 P15121 1/20 0.43
FAAH O00519 1/20 0.42
ALDH1A1 P00352 2/20 0.42
DNM1 Q05193 1/20 0.42
NAAA Q02083 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 1/20 0.41
GPR84 Q9NQS5 1/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41

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
SCHEMBL7549027 0.98 DGKA (0.53) DGKALMNAPAMCES2CES1
SCHEMBL7054538 0.98 DGKA (0.53) DGKALMNAPAMCES2CES1
SCHEMBL2014240 0.98 DGKA (0.53) DGKALMNAPAMCES2CES1
SCHEMBL7048641 0.98 DGKA (0.53) DGKALMNAPAMCES2CES1
SCHEMBL28942700 0.88 FAAH (0.54) LMNACES1MAPTFAAHPPARG
SCHEMBL7047742 0.85 ALDH1A1 (0.50) DGKALMNACES2CES1TSHR
SCHEMBL9954028 0.84 LMNA (0.53) DGKALMNAPAMCES2CES1
SCHEMBL11619204 0.84 LMNA (0.53) DGKALMNAPAMCES2CES1
SCHEMBL8162633 0.79 DGKA (0.50) DGKALMNAPAMCES2CES1
SCHEMBL16415782 0.79 DGKA (0.55) DGKALMNAPAMCES2CES1

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-0797443-B1 A PHARMACEUTICAL COMPOSITION WITH IMPROVED BIO-AVAILABILITY OF INOSITOL PHOSPHATE BIONERIS AB (SE) 2003-04-23 EP disclosed
US-5760022-A ESTER, ETHER PERSTORP AB (SE) 1998-06-02 US disclosed
EP-0797443-A1 A PHARMACEUTICAL COMPOSITION WITH IMPROVED BIO-AVAILABILITY OF INOSITOL PHOSPHATE PERSTORP AB (SE) 1997-10-01 EP disclosed
WO-1995019775-A1 A PHARMACEUTICAL COMPOSITION WITH IMPROVED BIO-AVAILABILITY OF INOSITOL PHOSPHATE PERSTORP AB (SE) 1995-07-27 WO disclosed