SCHEMBL11067335

SCHEMBL11067335

CCCC(C1CC(C)(C)N(C)C(C)(C)C1)(C1CC(C)(C)N(C)C(C)(C)C1)C(C(=O)OCc1ccc(O)c(C(C)(C)C)c1)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
XBP1 P17861 1/20 0.33
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 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
SCHEMBL7212084 0.81 GAA (0.37) GAA
SCHEMBL10825421 0.81 GAA (0.33) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL9063428 0.70 L3MBTL1 (0.51) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL7766757 0.69 GAA (0.36) GAA
SCHEMBL1695268 0.69 GAA (0.37) GAAATMNPSR1
SCHEMBL3033645 0.68 ATM (0.36) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL1695272 0.67 GAA (0.36) GAA
SCHEMBL28473328 0.66 GAA (0.36) GAAATMNPSR1
SCHEMBL3450609 0.66 ALDH1A1 (0.36) GAAATMNPSR1
SCHEMBL21822067 0.66 GAA (0.37) GAA

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
US-4442250-A HEAT, LIGHT, AND OXIDATION RESISTANCE CHIMOSA CHIMICA ORGANICA S.P.A. (IT) 1984-04-10 US disclosed