SCHEMBL7077319

SCHEMBL7077319

CC1(C(=O)OCC2CO2)CC=CCC1C(=O)OCC1CO1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALDH1A1 P00352 1/20 0.39
MGLL Q99685 3/20 0.32
HTT P42858 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
SCHEMBL11529622 0.77 ALDH1A1 (0.46) TP53CYP3A4ALDH1A1MGLL
SCHEMBL7728256 0.75 TP53 (0.53) TP53CYP3A4ALDH1A1
SCHEMBL7759124 0.73 TSHR (0.38) TP53CYP3A4ALDH1A1
SCHEMBL536513 0.73 TP53 (0.43) TP53CYP3A4ALDH1A1MGLL
SCHEMBL7728171 0.73 TP53 (0.43) TP53CYP3A4ALDH1A1
SCHEMBL427932 0.72 TP53 (0.65) TP53CYP3A4ALDH1A1MGLLHTT
SCHEMBL28405609 0.71 MEN1 (0.33) ALDH1A1
SCHEMBL15095468 0.71 ALDH1A1 (0.49) TP53CYP3A4ALDH1A1MGLL
SCHEMBL4248775 0.70 TP53 (0.57) TP53CYP3A4ALDH1A1MGLLHTT
SCHEMBL8590448 0.69 TSHR (0.45) TP53

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
US-20030021889-A1 Method for manufacturing multilayer circuit board ZEON CORPORATION (JP) 2003-01-30 US disclosed
US-4140606-A Process for preparing a polymerizable (meth) acrylate oligomer SHOWA DENKO K.K. (JP) 1979-02-20 US disclosed