SCHEMBL12901558

SCHEMBL12901558

CC(C)(C)c1cc2c(c(C(C)(C)C)c1)OC(=O)C2c1cc(C#N)cc(C#N)c1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.37
GABBR1 Q9UBS5 1/20 0.37
GRM2 Q14416 1/20 0.31

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
SCHEMBL10135359 0.93 GABBR2 (0.34) GABBR2GABBR1
SCHEMBL6873135 0.89 KIF11 (0.37) GABBR2GABBR1GRM2
SCHEMBL12901560 0.88 GRM2 (0.39) GABBR2GABBR1GRM2
SCHEMBL5083413 0.85 GABBR2 (0.43) GABBR2GABBR1
Water SCHEMBL28204716 0.83 GABBR2 (0.39) GABBR2GABBR1
SCHEMBL5083903 0.82 GABBR2 (0.40) GABBR2GABBR1
SCHEMBL5083915 0.81 GABBR2 (0.39) GABBR2GABBR1
SCHEMBL2612420 0.80 GABBR2 (0.41) GABBR2GABBR1
SCHEMBL10167275 0.80 GABBR2 (0.44) GABBR2GABBR1
SCHEMBL31247883 0.79 GAA (0.46) GABBR2GABBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2464739-B1 METHODS IN CELL CULTURES, AND RELATED INVENTIONS, EMPLOYING CERTAIN ADDITIVES BASF SE (DE) 2016-01-13 EP disclosed
US-8859235-B2 Methods in cell cultures, and related inventions, employing certain additives BASF SE (DE) 2014-10-14 US disclosed
WO-2011018472-A2 METHODS IN CELL CULTURES, AND RELATED INVENTIONS, EMPLOYING CERTAIN ADDITIVES BASF SE (DE) 2011-02-17 WO disclosed