SCHEMBL8050436

SCHEMBL8050436

CCC(=O)NCCCNC(C)C

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
RECQL P46063 1/20 0.42
EPHX1 P07099 1/20 0.40
CASP2 P42575 1/20 0.39
NAAA Q02083 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TP53 P04637 1/20 0.37
ALDH1A1 P00352 2/20 0.37

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
SCHEMBL24884918 0.96 MEN1 (0.71) MEN1KMT2ARECQLEPHX1CASP2
SCHEMBL25466799 0.94 MEN1 (0.68) MEN1KMT2ARECQLEPHX1CASP2
SCHEMBL25090248 0.94 MEN1 (0.68) MEN1KMT2ARECQLEPHX1CASP2
SCHEMBL25466788 0.94 MEN1 (0.68) MEN1KMT2ARECQLEPHX1CASP2
SCHEMBL25921370 0.94 MEN1 (0.68) MEN1KMT2ARECQLEPHX1CASP2
SCHEMBL18677306 0.87 MEN1 (0.56) MEN1KMT2ARECQLEPHX1ALDH1A1
SCHEMBL10101148 0.84 MEN1 (0.89) MEN1KMT2ARECQLEPHX1CASP2
SCHEMBL14000019 0.84 CASP2 (0.60) MEN1KMT2AEPHX1CASP2NAAA
SCHEMBL25466986 0.83 MEN1 (0.59) MEN1KMT2ARECQLEPHX1CASP2
SCHEMBL22837715 0.83 MEN1 (0.53) MEN1KMT2ARECQLEPHX1CASP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009061448-A9 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PROTEINURIC DISEASES THE GENERAL HOSPITAL CORPORATION (US) 2009-08-13 WO disclosed