SCHEMBL9243124

SCHEMBL9243124

C=C(CC(C)(C)OOC(C)(C)C)C(=O)OOC(=O)OCC

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
SOAT1 P35610 1/20 0.33
TSHR P16473 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
SCHEMBL9241740 0.85 ALDH1A1 (0.33) ALDH1A1SOAT1
SCHEMBL5597022 0.78 ALDH1A1 (0.40) ALDH1A1SOAT1TSHR
SCHEMBL9242073 0.77 ALDH1A1 (0.33) ALDH1A1SOAT1
SCHEMBL9239041 0.77 ALDH1A1 (0.33) ALDH1A1SOAT1
SCHEMBL9243749 0.74 ALDH1A1 (0.32) ALDH1A1SOAT1
SCHEMBL27897713 0.72 ALDH1A1 (0.55) ALDH1A1SOAT1TSHR
SCHEMBL9847962 0.72 ALDH1A1 (0.38) ALDH1A1SOAT1TSHR
SCHEMBL9242773 0.71 TSHR (0.33) TSHR
SCHEMBL11655472 0.71 GAA (0.44) ALDH1A1SOAT1TSHR
SCHEMBL9240470 0.71 TET2 (0.50) TSHR

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
EP-0579434-B1 Dialkyl peroxide, cross-linking composition containing the same, method for cross-linking, and electric power cable NOF CORP (JP) 1995-10-18 EP claimed