SCHEMBL8976175

SCHEMBL8976175

C=CCC(COCCOCCOCCO)OC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TSHR P16473 4/20 0.32
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 1/20 0.32
THRB P10828 1/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 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
SCHEMBL10902723 1.00 MEN1 (0.35) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL10902185 0.97 TSHR (0.33) TSHRMAPK1
SCHEMBL231579 0.86 TSHR (0.42) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL3544599 0.84 MEN1 (0.46) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL3542781 0.84 MEN1 (0.46) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL3547868 0.80 TSHR (0.39) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL148188 0.78 TSHR (0.41) MEN1KMT2ATSHRMAPK1ALDH1A1
Ethylene Glycol SCHEMBL10901670 0.78 TSHR (0.31) TSHR
SCHEMBL3547324 0.78 MEN1 (0.39) MEN1KMT2ATSHRMAPK1THRB
Bicarbonate SCHEMBL10902739 0.77 MEN1 (0.38) MEN1KMT2ATSHRMAPK1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8072422-A None JP disclosed
JP-H0872422-A PRINTING PAPER SONY CORP 1996-03-19 JP disclosed