SCHEMBL1697185

SCHEMBL1697185

CC(C)(C)c1cccc([C]O)c1C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.46
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALOX12 P18054 1/20 0.34
NPSR1 Q6W5P4 1/20 0.32
KIF11 P52732 1/20 0.32
NAMPT P43490 1/20 0.31
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
ATP2A2 P16615 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ATP2A3 Q93084 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
SCHEMBL9769910 0.83 CA2 (0.44) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL8099528 0.80 ALDH1A1 (0.50) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL634438 0.79 CA2 (0.41) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL13209347 0.79 CA2 (0.41) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL304569 0.77 CA2 (0.57) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL29395629 0.71 ALDH1A1 (0.62) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL144221 0.71 ALDH1A1 (0.62) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL11954793 0.70 CA2 (0.56) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL11572403 0.70 CA2 (0.50) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL4461655 0.70 CA2 (0.50) CA2GABRA1GABRB2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2575750-A2 SUNSCREEN COMPOSITIONS CONTAINING HYDROLYZED JOJOBA ESTERS FOR IMPROVED WATER RESISTANCE International Flora Technologies, Ltd. (US) 2013-04-10 EP claimed
WO-2011149929-A2 SUNSCREEN COMPOSITIONS CONTAINING HYDROLYZED JOJOBA ESTERS FOR IMPROVED WATER RESISTANCE INTERNATIONAL FLORA TECHNOLOGIES LTD. (US) 2011-12-01 WO claimed
EP-0711540-B1 Cosmetic or dermatologic oil/water dispersion stabilized with cubic gel particles and method of preparation OREAL (FR) 2000-05-10 EP disclosed
EP-0711540-A1 Cosmetic or dermatologic oil/water dispersion stabilized with cubic gel particles and method of preparation L'OREAL (FR) 1996-05-15 EP disclosed