SCHEMBL11644752

SCHEMBL11644752

CCC(=O)C(C)(C)OOC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.40
TSHR P16473 1/20 0.40
FFAR3 O14843 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
Butanone SCHEMBL1050116 0.76 ALDH1A1 (0.59) TDP1TSHRFFAR3ALDH1A1
SCHEMBL30992121 0.75
SCHEMBL30992130 0.74
SCHEMBL7732801 0.74
SCHEMBL11659259 0.73 CYP4F2 (0.46) TDP1TSHRALDH1A1
SCHEMBL20156712 0.72 CYP4F2 (0.36) TDP1FFAR3ALDH1A1
SCHEMBL14509111 0.72 SOAT1 (0.36) TDP1FFAR3ALDH1A1
SCHEMBL20988010 0.71 CYP4F2 (0.33)
SCHEMBL855979 0.70 TSHR (0.47) TDP1TSHRALDH1A1
SCHEMBL28824596 0.70 TSHR (0.47) TDP1TSHRALDH1A1

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-20240110048-A1 POLYPROPYLENE PEROXIDE MASTERBATCH FINA TECHNOLOGY, INC. 2024-04-04 US disclosed
WO-2024073539-A1 POLYPROPYLENE PEROXIDE MASTERBATCH FINA TECHNOLOGY, INC. (US) 2024-04-04 WO disclosed
US-4088642-A FREE RADICAL POLYMERIZATION CATALYSTS PENNWALT CORPORATION (US) 1978-05-09 US disclosed