SCHEMBL7073368

SCHEMBL7073368

CCC1(CC)C(=O)N(C(C)(C)C)CC(C)(C)N1OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
TSHR P16473 1/20 0.39
ELANE P08246 3/20 0.34
DHFR P00374 3/20 0.34
TP53 P04637 1/20 0.33
GAA P10253 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MMP2 P08253 1/20 0.32
MMP13 P45452 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
SCHEMBL7066871 0.88 ALDH1A1 (0.42) ALDH1A1TSHRELANEDHFRTP53
SCHEMBL7071191 0.80 ALDH1A1 (0.44) ALDH1A1TSHRELANEDHFRTP53
SCHEMBL6884754 0.79 ELANE (0.30) ELANE
SCHEMBL13110352 0.72 MAPT (0.30)
SCHEMBL13050903 0.71
SCHEMBL7066888 0.69 ELANE (0.30) ELANE
SCHEMBL9242285 0.68 ALDH1A1 (0.54) ALDH1A1TSHRELANEDHFRTP53
SCHEMBL6031955 0.68 ALDH1A1 (0.34) ALDH1A1ELANEDHFRGAANPSR1
Hydrochloric Acid SCHEMBL2137332 0.68
SCHEMBL7071716 0.66

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-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