SCHEMBL6941490

SCHEMBL6941490

CCC(=O)CC1C(C)=CCC(C)C1(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 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
SCHEMBL3375272 0.78 ALDH1A1 (0.33) ALDH1A1CYP3A4ALOX15TDP1
SCHEMBL3375271 0.78 ALDH1A1 (0.33) ALDH1A1CYP3A4ALOX15TDP1
SCHEMBL2426813 0.76 TSHR (0.37) TSHRMAPK1
SCHEMBL2426815 0.76 TSHR (0.37) TSHRMAPK1
SCHEMBL2426817 0.76 TSHR (0.37) TSHRMAPK1
SCHEMBL2863012 0.75 TSHR (0.32) TSHRMAPK1
SCHEMBL1229826 0.73 ALOX15 (0.51) ALDH1A1CYP3A4ALOX15TDP1
SCHEMBL9016181 0.72 PRKCA (0.38) ALOX15
SCHEMBL9016178 0.72 PRKCA (0.38) ALOX15
SCHEMBL2426251 0.69 TSHR (0.34) TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1305391-A1 CLEANING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2003-05-02 EP disclosed
EP-1305392-A1 CLEANING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2003-05-02 EP disclosed
EP-1305383-A1 CLEANING COMPOSITION 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-2002008373-A1 CLEANING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2002-01-31 WO 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
WO-2002006436-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