SCHEMBL4952249

SCHEMBL4952249

CCC1(COC(=O)C(C)(C)C)COC(=O)C(CC)(CC)N1[O]

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.38
PRKCA P17252 18/20 0.36
PRKCE Q02156 3/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RASGRP3 Q8IV61 1/20 0.32

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
SCHEMBL4952252 0.87 SMN1; SMN2 (0.38) SMN1; SMN2PRKCAPRKCE
SCHEMBL4953813 0.84 PRKCA (0.38) SMN1; SMN2PRKCAPRKCEPOLBGAA
SCHEMBL4953984 0.80
SCHEMBL4953817 0.76 PRKCA (0.38) SMN1; SMN2PRKCAPRKCE
SCHEMBL7070697 0.76 TSHR (0.34) SMN1; SMN2PRKCAPRKCERASGRP3
SCHEMBL12059177 0.74 PRKCA (0.39) SMN1; SMN2PRKCAPRKCERASGRP3
SCHEMBL4954525 0.71 PRKCA (0.40) SMN1; SMN2PRKCAPRKCEPOLBGAA
SCHEMBL4953987 0.69
SCHEMBL7070815 0.68 PRKCA (0.37) PRKCAPRKCERASGRP3
SCHEMBL3123580 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1873199-A1 In-can stabilizers Ciba Specialty Chemicals Holding Inc. (CH) 2008-01-02 EP disclosed
US-20070225397-A1 In-Can Stabilizers CIBA SPECIALTY CHEMICALS CORP. 2007-09-27 US disclosed
US-6664353-B2 Compounds providing stable free radical-mediated polymerization processes which yield polymers having low polydispersity at enhanced rates of polymerization and enhanced monomer to polymer conversions CIBA SPECIALTY CHEMICALS CORPORATION 2003-12-16 US disclosed
US-20030125494-A1 Heterocyclic alkoxyamines as regulators in controlled radical polymerization processes NESVADBA PETER (CH) 2003-07-03 US disclosed
US-6479608-B1 Heterocyclic alkoxyamines as regulators in controlled radical polymerization processes CIBA SPECIALTY CHEMICALS CORPORATION 2002-11-12 US disclosed