SCHEMBL11772829

SCHEMBL11772829

CC1(C)C(=O)N(Cc2ccccc2)C(=O)C(C)(C)N1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.68
CTSG P08311 2/20 0.54
PRTN3 P24158 1/20 0.54
F2 P00734 1/20 0.52
PLG P00747 1/20 0.52
CMA1 P23946 1/20 0.52
CTRC Q99895 1/20 0.52
NPSR1 Q6W5P4 2/20 0.51
KMT2A Q03164 4/20 0.50
CYP2C19 P33261 4/20 0.50
MEN1 O00255 3/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CRHBP P24387 1/20 0.50
HTT P42858 1/20 0.50
CRHR2 Q13324 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
GSK3A P49840 1/20 0.48
GSK3B P49841 1/20 0.48

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
SCHEMBL11453870 0.80 ELANE (0.70) ELANECTSGPRTN3F2PLG
SCHEMBL19923520 0.77 ELANE (0.61) ELANECTSGPRTN3F2PLG
SCHEMBL9524116 0.76 ELANE (0.70) ELANECTSGPRTN3F2PLG
SCHEMBL9524405 0.76 ELANE (0.70) ELANECTSGPRTN3F2PLG
SCHEMBL8498625 0.75 KMT2A (0.64) ELANECTSGPRTN3F2PLG
SCHEMBL11773467 0.73 KMT2A (0.57) ELANECTSGPRTN3F2PLG
SCHEMBL9357173 0.72 ELANE (0.50) ELANECTSGPRTN3F2PLG
SCHEMBL20051948 0.71 ELANE (0.57) ELANECTSGPRTN3F2PLG
SCHEMBL16865430 0.71 CYP2C19 (0.58) ELANECTSGPRTN3F2PLG
SCHEMBL4002616 0.70 ELANE (0.61) ELANECTSGPRTN3F2PLG

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
US-3936456-A Substituted piperazine dione oxyls and hydroxides and polymer compositions stabilized thereby CIBY-GEIGY CORPORATION (US) 1976-02-03 US claimed
US-20070231744-A1 Holographic recording medium KABUSHIKI KAISHA TOSHIBA (JP) 2007-10-04 US disclosed
US-20070231744-A1 Holographic recording medium KABUSHIKI KAISHA TOSHIBA (JP) 2007-10-04 US disclosed
US-3936456-A Substituted piperazine dione oxyls and hydroxides and polymer compositions stabilized thereby CIBY-GEIGY CORPORATION (US) 1976-02-03 US disclosed