SCHEMBL17629680

SCHEMBL17629680

CC=CCCC(O)CC(C)C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL17629679 1.00 PPARG (0.33) PPARGPPARDPPARA
SCHEMBL5868466 0.86 ALDH1A1 (0.32) PPARGPPARDPPARA
SCHEMBL5868463 0.86 ALDH1A1 (0.32) PPARGPPARDPPARA
SCHEMBL5907120 0.82 ANPEP (0.30)
SCHEMBL9419929 0.80 THRB (0.39)
SCHEMBL9679401 0.80 THRB (0.39)
SCHEMBL9679410 0.80 THRB (0.39)
SCHEMBL9419917 0.80 THRB (0.39)
SCHEMBL9419928 0.80 THRB (0.39)
SCHEMBL12501946 0.80 TSHR (0.32)

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-3197511-A1 PERSONAL CARE COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2017-08-02 EP claimed
WO-2016049455-A1 PERSONAL CARE COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO claimed