SCHEMBL6936899

SCHEMBL6936899

CCCC(=O)C=CCC1C(C)=CCCC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP3A4 P08684 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
IAPP P10997 2/20 0.34
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL11445027 0.89 ALOX15 (0.63) ALOX15ALDH1A1CYP3A4TDP1IAPP
SCHEMBL11445028 0.89 ALOX15 (0.63) ALOX15ALDH1A1CYP3A4TDP1IAPP
SCHEMBL6943320 0.81 ALOX15 (0.46) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL28369789 0.79 ALOX15 (0.50) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL1275696 0.78 ALDH1A1 (0.80) ALOX15ALDH1A1CYP3A4TDP1IAPP
SCHEMBL1275695 0.78 ALDH1A1 (0.80) ALOX15ALDH1A1CYP3A4TDP1IAPP
SCHEMBL18770286 0.78 ALOX15 (0.40) ALOX15ALDH1A1CYP3A4TDP1
SCHEMBL29473931 0.78 ALOX15 (0.40) ALOX15ALDH1A1CYP3A4TDP1
SCHEMBL20262288 0.78 ALOX15 (0.40) ALOX15ALDH1A1CYP3A4TDP1
SCHEMBL2778316 0.78 ALOX15 (0.40) ALOX15ALDH1A1CYP3A4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1305392-A1 CLEANING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2003-05-02 EP disclosed
EP-1305388-A1 CLEANING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2003-05-02 EP disclosed
WO-2002008374-A1 CLEANING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2002-01-31 WO disclosed
WO-2002006437-A1 CLEANING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2002-01-24 WO disclosed
EP-0980238-A1 STYLING SHAMPOO COMPOSITIONS CONTAINING AN ODOR MASKING BASE THE PROCTER & GAMBLE COMPANY (US) 2000-02-23 EP disclosed
WO-1998050011-A1 STYLING SHAMPOO COMPOSITIONS CONTAINING AN ODOR MASKING BASE THE PROCTER & GAMBLE COMPANY (US) 1998-11-12 WO disclosed