SCHEMBL20819486

SCHEMBL20819486

CC=CCC/C=C/C(C)O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL3906421 1.00 PPARG (0.36) PPARGPPARDPPARAALDH1A1TSHR
SCHEMBL3906424 1.00 PPARG (0.36) PPARGPPARDPPARAALDH1A1TSHR
SCHEMBL3983883 0.97 PPARG (0.35) PPARGPPARDPPARA
SCHEMBL29799275 0.97 PPARG (0.35) PPARGPPARDPPARA
SCHEMBL3983881 0.97 PPARG (0.35) PPARGPPARDPPARA
SCHEMBL11146523 0.90 MEN1 (0.34) PPARGPPARDPPARAALDH1A1
SCHEMBL11146520 0.90 MEN1 (0.34) PPARGPPARDPPARAALDH1A1
SCHEMBL17350090 0.80 PPARG (0.34) PPARGPPARDPPARAALDH1A1
SCHEMBL17350089 0.80 PPARG (0.34) PPARGPPARDPPARAALDH1A1
SCHEMBL8578212 0.79

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-3684858-A1 ADDITIVE MIXTURE BASF SE (DE) 2020-07-29 EP disclosed
WO-2019053187-A1 ADDITIVE MIXTURE BASF SE (DE) 2019-03-21 WO disclosed