SCHEMBL8722173

SCHEMBL8722173

CCCCC(Oc1ccccc1)C(=O)OC(=O)C(CCCC)Oc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.51
ALOX5 P09917 2/20 0.51
PTGES O14684 1/20 0.51
PPARA Q07869 10/20 0.47
CTRC Q99895 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
CNR2 P34972 1/20 0.44
ALDH1A1 P00352 2/20 0.43
CA2 P00918 1/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.42

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
SCHEMBL11577652 0.94 CTRC (0.52) PPARGALOX5PTGESPPARACTRC
SCHEMBL11617518 0.94 CTRC (0.52) PPARGALOX5PTGESPPARACTRC
SCHEMBL11858517 0.89 PPARG (0.50) PPARGALOX5PTGESPPARACTRC
SCHEMBL5210592 0.89 TDP1 (0.54) PPARGALOX5PTGESPPARACTRC
SCHEMBL8935884 0.87 PPARG (0.64) PPARGALOX5PTGESPPARACTRC
SCHEMBL289442 0.87 PPARG (0.64) PPARGALOX5PTGESPPARACTRC
SCHEMBL7248945 0.86 PPARG (0.51) PPARGALOX5PTGESPPARACTRC
SCHEMBL28003097 0.86 PPARG (0.51) PPARGALOX5PTGESPPARACTRC
SCHEMBL11617523 0.84 CTRC (0.47) PPARGALOX5PTGESPPARACTRC
SCHEMBL11577658 0.84 CTRC (0.47) PPARGALOX5PTGESPPARACTRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0886641-A2 SYNTHESIS OF METHOXY NUCLEOSIDES AND ENZYMATIC NUCLEIC ACID MOLECULES RIBOZYME PHARMACEUTICALS, INC. (US) 1998-12-30 EP disclosed
WO-1997026270-A2 SYNTHESIS OF METHOXY NUCLEOSIDES AND ENZYMATIC NUCLEIC ACID MOLECULES RIBOZYME PHARMACEUTICALS, INC. (US) 1997-07-24 WO disclosed