SCHEMBL13620472

SCHEMBL13620472

CCCC(C)(CC)n1c(=O)c2cc3c(=O)n(C)c(=O)c3cc2c1=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.33
POLB P06746 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 2/20 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
SCHEMBL13618639 0.90 GAA (0.37) GAAPOLBNPSR1ALDH1A1
SCHEMBL24255183 0.82 GAA (0.37) GAAPOLBNPSR1ALDH1A1
SCHEMBL24255093 0.77 GAA (0.34) GAAPOLBNPSR1ALDH1A1
SCHEMBL14116620 0.76 CA12 (0.35)
SCHEMBL24417925 0.75 GAA (0.37) GAAPOLBNPSR1ALDH1A1
SCHEMBL14615890 0.75 CA12 (0.35)
SCHEMBL21129236 0.74 GAA (0.37) GAAPOLBNPSR1ALDH1A1
SCHEMBL13527794 0.74 ALDH1A1 (0.43) GAAPOLBNPSR1ALDH1A1
SCHEMBL24961351 0.73 MAPK1 (0.30)
SCHEMBL15443657 0.72 POLB (0.32) GAAPOLBNPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2119739-A2 Polyimide, polyamic acid and processes for the production thereof Mitsubishi Gas Chemical Company, Inc. (JP) 2009-11-18 EP disclosed