SCHEMBL24255183

SCHEMBL24255183

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

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.37
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ALDH1A1 P00352 3/20 0.36
SRC P12931 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
SCHEMBL24255093 0.94 GAA (0.34) GAAPOLBNPSR1ALDH1A1SRC
SCHEMBL24417925 0.92 GAA (0.37) GAAPOLBNPSR1ALDH1A1SRC
SCHEMBL13618639 0.92 GAA (0.37) GAAPOLBNPSR1ALDH1A1
SCHEMBL13527794 0.90 ALDH1A1 (0.43) GAAPOLBNPSR1ALDH1A1SRC
SCHEMBL15443657 0.89 POLB (0.32) GAAPOLBNPSR1ALDH1A1
SCHEMBL13753120 0.86 GAA (0.36) GAAPOLBNPSR1ALDH1A1SRC
SCHEMBL15462790 0.83 MAPK1 (0.49) POLBALDH1A1
SCHEMBL24255016 0.82 ALDH1A1 (0.41) GAAPOLBNPSR1ALDH1A1SRC
SCHEMBL13620472 0.82 GAA (0.33) GAAPOLBNPSR1ALDH1A1
SCHEMBL15462788 0.81 TDP1 (0.47) ALDH1A1

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
WO-2022036307-A1 PERMANENT BONDING AND PATTERNING MATERIAL BREWER SCIENCE, INC. (US) 2022-02-17 WO disclosed