SCHEMBL3663413

SCHEMBL3663413

C=CCOCCO.C=CCOCCOCCOCCO

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
TSHR P16473 6/20 0.53
MAPK1 P28482 1/20 0.53
POLB P06746 1/20 0.41
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 4/20 0.38
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA7 P43166 1/20 0.37
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 1/20 0.36
CA9 Q16790 1/20 0.33
APP P05067 2/20 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
SCHEMBL30969126 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1POLB
SCHEMBL15103276 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1POLB
SCHEMBL13755793 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1POLB
SCHEMBL16491144 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1POLB
SCHEMBL16491141 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1POLB
SCHEMBL426462 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1POLB
SCHEMBL426095 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1POLB
SCHEMBL7884151 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1POLB
SCHEMBL7879363 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1POLB
SCHEMBL28443499 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1POLB

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-8298610-B2 Process for inhibiting oxide formation on copper surfaces E I DU PONT DE NEMOURS AND COMPANY (US) 2012-10-30 US disclosed
US-20120160266-A1 PROCESS FOR INHIBITING OXIDE FORMATION ON COPPER SURFACES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-28 US disclosed
US-20100215841-A1 PROCESS FOR INHIBITING OXIDE FORMATION ON COPPER SURFACES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-08-26 US disclosed