SCHEMBL2973203

SCHEMBL2973203

O=C(OCC1CCC2OC2C1)C1C=CCCC1C(=O)OCC1CCC2OC2C1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.31
▸ CYP3A4 P08684 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
SCHEMBL5425239 0.82 TP53 (0.40) TP53CYP3A4
SCHEMBL11490731 0.78 TP53 (0.51) TP53CYP3A4
SCHEMBL29753313 0.77 MAPK1 (0.37) TP53CYP3A4
SCHEMBL12431725 0.76 MIF (0.34) —
SCHEMBL10349616 0.76 TP53 (0.33) TP53CYP3A4
SCHEMBL13935567 0.75 PPM1B (0.49) TP53CYP3A4
SCHEMBL7242807 0.75 TP53 (0.35) TP53CYP3A4
SCHEMBL22448093 0.75 TP53 (0.35) TP53CYP3A4
SCHEMBL232171 0.75 TP53 (0.57) TP53CYP3A4
SCHEMBL12974649 0.74 PPM1B (0.39) TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7687593-B2 Fluorinated polymer and polymer composition CHISSO CORPORATION (JP) 2010-03-30 — — US disclosed
US-20070135602-A1 Fluorinated polymer and polymer composition CHISSO CORPORATION 2007-06-14 — — US disclosed
US-4218360-A Epoxy resins filled with dual-silane treated hydrated alumina UNION CARBIDE CORPORATION (US) 1980-08-19 — — US disclosed
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