SCHEMBL13025474

SCHEMBL13025474

CCCOCCOCC(=O)NCCOCCOCC(=O)CC

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
EPHX2 P34913 1/20 0.39
GLP1R P43220 8/20 0.38
TSHR P16473 1/20 0.38
RECQL P46063 1/20 0.38
FAAH O00519 1/20 0.36
NAMPT P43490 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
NCF1 P14598 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL25029532 0.92 MEN1 (0.44) MEN1KMT2AGLP1RTSHRRECQL
SCHEMBL13024328 0.90 CASP2 (0.42) MEN1KMT2AGLP1RTSHRRECQL
SCHEMBL13024334 0.90 ALDH1A1 (0.40) MEN1KMT2AEPHX2GLP1RTSHR
SCHEMBL13025473 0.89 MEN1 (0.39) MEN1KMT2AGLP1RTSHRRECQL
SCHEMBL13024335 0.89 MEN1 (0.39) MEN1KMT2AGLP1RTSHRRECQL
SCHEMBL13024561 0.89 MEN1 (0.39) MEN1KMT2AGLP1RTSHRRECQL
SCHEMBL21106543 0.88 MEN1 (0.47) MEN1KMT2AGLP1RTSHRRECQL
SCHEMBL13684294 0.87 ALDH1A1 (0.40) MEN1KMT2AEPHX2TSHRRECQL
SCHEMBL23696405 0.87 CASP2 (0.44) MEN1KMT2AGLP1R
SCHEMBL19277702 0.87 CASP2 (0.44) MEN1KMT2AGLP1R

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
US-20100317057-A1 SEMI-RECOMBINANT PREPARATION OF GLP-1 ANALOGUES NOVO NORDISK A/S (DK) 2010-12-16 US disclosed