SCHEMBL9239290

SCHEMBL9239290

C=CCOC(=O)OCC(C)(C)OOC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
CYP3A4 P08684 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
MAPT P10636 1/20 0.31
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL5711975 0.80 TSHR (0.39) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL9245659 0.79 THRB (0.46) TSHRCYP3A4SMN1; SMN2
SCHEMBL6565508 0.78 TSHR (0.38) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL6534505 0.77 TSHR (0.42) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL11299670 0.77 TSHR (0.35) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL9241209 0.77 ALDH1A1 (0.50) TSHRCYP3A4TDP1SMN1; SMN2
SCHEMBL28267237 0.77 TSHR (0.37) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL9240430 0.76
SCHEMBL28748118 0.76 TSHR (0.39) TSHRCYP3A4TDP1MAPTCACNA1B
SCHEMBL6864611 0.75 CYP3A4 (0.42) TSHRCYP3A4TDP1MAPTCACNA1B

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 4 patents. 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
EP-0579434-A1 Dialkyl peroxide, cross-linking composition containing the same, method for cross-linking, and electric power cable NOF CORPORATION (JP) 1994-01-19 EP claimed
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 disclosed
EP-0579434-A1 Dialkyl peroxide, cross-linking composition containing the same, method for cross-linking, and electric power cable NOF CORPORATION (JP) 1994-01-19 EP disclosed