SCHEMBL6471876

SCHEMBL6471876

[CH2]COCCOCCNC(=O)CON

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NCF1 P14598 1/20 0.36
CA2 P00918 6/20 0.35
CA12 O43570 4/20 0.35
CA1 P00915 4/20 0.35
CA4 P22748 4/20 0.35
CA9 Q16790 4/20 0.35
CA14 Q9ULX7 4/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TSHR P16473 2/20 0.31
CTH P32929 1/20 0.31
CBS P35520 1/20 0.31
THPO P40225 1/20 0.31
RECQL P46063 1/20 0.31
THRB P10828 1/20 0.30
GLP1R P43220 5/20 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
SCHEMBL12029017 0.91 MEN1 (0.44) MEN1KMT2ANCF1CA2CA12
SCHEMBL24591513 0.84 MEN1 (0.39) MEN1KMT2ANCF1CA2CA12
SCHEMBL270173 0.84 MEN1 (0.39) MEN1KMT2ANCF1CA2CA12
SCHEMBL19655511 0.82 TSHR (0.42) MEN1KMT2ANCF1CA2CA12
SCHEMBL12154988 0.82 MEN1 (0.45) MEN1KMT2ANCF1CA2CA12
SCHEMBL15905956 0.82 MEN1 (0.42) MEN1KMT2ANCF1CA2CA12
SCHEMBL12393779 0.82 MEN1 (0.42) MEN1KMT2ANCF1CA2CA12
SCHEMBL15473930 0.82 MEN1 (0.42) MEN1KMT2ANCF1CA2CA12
SCHEMBL5912367 0.82 MEN1 (0.38) MEN1KMT2ANCF1CA2CA12
SCHEMBL15758263 0.82 MEN1 (0.38) MEN1KMT2ANCF1CA2CA12

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
EP-1577293-A1 METHOD OF PURIFYING/CONCENTRATING SUGAR CHAIN WITH SUGAR CHAIN-TRAPPING MOLECULE AND METHOD OF ANALYZING SUGAR CHAIN STRUCTURE Shionogi Co., Ltd. (JP) 2005-09-21 EP disclosed