SCHEMBL11569438

SCHEMBL11569438

CC(O)(CO)OCCOCCOC(C)(O)CO

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30
MAPT P10636 1/20 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
SCHEMBL1836600 0.75 TSHR (0.41) MEN1KMT2ATSHRTHRBHTT
SCHEMBL1833616 0.73 MEN1 (0.40) MEN1KMT2ATSHRTHRBHTT
SCHEMBL1838062 0.73 ALDH1A1 (0.35) MAPK1
SCHEMBL28071182 0.72
SCHEMBL1839694 0.72 MEN1 (0.43) MEN1KMT2ATSHRTHRBHTT
SCHEMBL100909 0.72 MEN1 (0.43) MEN1KMT2ATSHRTHRBHTT
SCHEMBL28781645 0.72 MEN1 (0.43) MEN1KMT2ATSHRTHRBHTT
SCHEMBL431202 0.70
SCHEMBL28149715 0.70
SCHEMBL9063757 0.69 MEN1 (0.32) MEN1KMT2ATSHR

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-4179337-A POLYALKYLENE GLYCOL LINKED TO POLYPEPTIDE THROUGH COUPLER RESEARCH CORPORATION TECHNOLOGIES, INC., A NOT-FOR-PROFIT, NON-STOCK CORP. OF DE 1979-12-18 US disclosed