SCHEMBL28098697

SCHEMBL28098697

OCCOCCOCCOCC(CO)OCCOCCO

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 1/20 0.40
ALDH1A1 P00352 2/20 0.33
USP2 O75604 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL21855420 1.00 MEN1 (0.50) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL1219820 1.00 MEN1 (0.50) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL13028968 0.95 MEN1 (0.50) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL19543624 0.91 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL6433059 0.91 TSHR (0.43) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL12317025 0.91 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16248431 0.91 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL21855423 0.91 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL17932926 0.91 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL15353970 0.91 MEN1 (0.55) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103917576-B Polyether polyol resin composition 瀚森公司 2016-10-05 CN disclosed