SCHEMBL7071090

SCHEMBL7071090

CCC1(C)C(=O)N(C(C)C)CC(C)(C)N1OC(C)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
TACR1 P25103 1/20 0.32
ELANE P08246 2/20 0.32
CTSD P07339 1/20 0.31
CTSE P14091 1/20 0.31
BACE1 P56817 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.30
KCNH2 Q12809 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
CHRM1 P11229 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL7069061 0.88 OPRM1 (0.33) OPRM1OPRD1OPRK1OPRL1TACR1
SCHEMBL7066888 0.83 ELANE (0.30) ELANE
SCHEMBL7071196 0.77 ELANE (0.32) OPRM1OPRD1OPRK1OPRL1TACR1
SCHEMBL7070371 0.77 IDH1 (0.34)
SCHEMBL6031954 0.75 HTR2B (0.32)
SCHEMBL7067657 0.75
SCHEMBL7073839 0.75 ELANE (0.36) OPRM1OPRD1OPRK1OPRL1ELANE
SCHEMBL6884754 0.74 ELANE (0.30) ELANE
SCHEMBL3390007 0.73 MEN1 (0.37) TACR1ELANEALDH1A1HPGDNPSR1
SCHEMBL7069003 0.73 ELANE (0.32) ELANE

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