SCHEMBL28804657

SCHEMBL28804657

OCCOCCOCCOCCOCCC(O)CO

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
THRB P10828 2/20 0.50
TSHR P16473 2/20 0.50
MAPK1 P28482 1/20 0.50
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.38
USP2 O75604 1/20 0.33

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
SCHEMBL9643980 1.00 MEN1 (0.55) MEN1KMT2ATHRBTSHRMAPK1
SCHEMBL864266 0.97 TSHR (0.53) MEN1KMT2ATHRBTSHRMAPK1
Triethylene Glycol SCHEMBL21571488 0.90 THRB (0.65) MEN1KMT2ATHRBTSHRMAPK1
SCHEMBL18440476 0.89 THRB (0.53) MEN1KMT2ATHRBTSHRMAPK1
Glycerin SCHEMBL4597460 0.87 MEN1 (0.65) MEN1KMT2ATHRBTSHRMAPK1
Pentaethylene Glycol SCHEMBL6681000 0.87 MEN1 (0.65) MEN1KMT2ATHRBTSHRMAPK1
Triethylene Glycol SCHEMBL618788 0.87 MEN1 (0.65) MEN1KMT2ATHRBTSHRMAPK1
Triethylene Glycol SCHEMBL21081708 0.87 MEN1 (0.65) MEN1KMT2ATHRBTSHRMAPK1
Hexaethylene Glycol SCHEMBL11352521 0.87 MEN1 (0.65) MEN1KMT2ATHRBTSHRMAPK1
Tetraethylene Glycol SCHEMBL617711 0.87 MEN1 (0.65) MEN1KMT2ATHRBTSHRMAPK1

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
CN-114846040-A Polymer and coating composition containing the same DIC株式会社 2022-08-02 CN disclosed