SCHEMBL3709015

SCHEMBL3709015

CCCCCCCCCCCCC1(C(C)(C)C)C=CC=C(C(C)(C)C)C1O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 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
SCHEMBL1846553 1.00 GAA (0.33) GAA
SCHEMBL1847614 0.94 GAA (0.30) GAA
SCHEMBL9190920 0.66
SCHEMBL11059622 0.66 POLA1 (0.32) GAA
SCHEMBL11134128 0.62
SCHEMBL887719 0.60 GAA (0.30) GAA
SCHEMBL31186400 0.59 PTPN1 (0.37) GAA
SCHEMBL31186272 0.59 PTPN1 (0.37) GAA
SCHEMBL9615817 0.59 GBA1 (0.32) GAA
SCHEMBL31186294 0.59 PTPN1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2398875-A1 COMPOSITION CONTAINING ESTER COMPOUNDS AND A METHOD OF LUBRICATING AN INTERNAL COMBUSTION ENGINE The Lubrizol Corporation (US) 2011-12-28 EP disclosed
WO-2010096286-A1 COMPOSITION CONTAINING ESTER COMPOUNDS AND A METHOD OF LUBRICATING AN INTERNAL COMBUSTION ENGINE THE LUBRIZOL CORPORATION (US) 2010-08-26 WO disclosed