SCHEMBL2961810

SCHEMBL2961810

COC(COCCOCCO)NC(COCCOCCO)OC

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TSHR P16473 2/20 0.42
MAPK1 P28482 1/20 0.42
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL601146 0.96 TSHR (0.39) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL30244421 0.76 MEN1 (0.52) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL30244896 0.76 MEN1 (0.52) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL30244716 0.76 MEN1 (0.52) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL5531243 0.76 MEN1 (0.52) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL2936139 0.76 MEN1 (0.52) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL30380499 0.76 MEN1 (0.52) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL98075 0.74 MEN1 (0.50) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL829630 0.74 MEN1 (0.50) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL10477016 0.74 MEN1 (0.50) MEN1KMT2ATSHRMAPK1THRB

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-7759454-B2 Process for preparing amides based on polyetheramines and (meth)acrylic acid CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2010-07-20 US disclosed
US-20060252884-A1 Process for preparing amides based on polyetheramines and (meth)acrylic acid CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2006-11-09 US disclosed
EP-1104422-A1 PHENYL XANTHINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2001-06-06 EP disclosed
WO-2000009507-A1 PHENYL YANTHINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2000-02-24 WO disclosed