SCHEMBL16669702

SCHEMBL16669702

CCOCC1COC(C)(COCC)O1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 1/20 0.38
CA2 P00918 1/20 0.36
CYP2D6 P10635 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ASGR1 P07306 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM3 P20309 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
SCHEMBL14457149 0.84 CA2 (0.34) CTDSP1CA2
SCHEMBL13620101 0.84 CTDSP1 (0.37) CTDSP1CA2CYP2D6SLC6A2SLC6A4
SCHEMBL1487288 0.79 CA2 (0.54) CA2CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL1786903 0.79 CA2 (0.54) CA2CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL12967131 0.79 CA2 (0.54) CA2CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL16670076 0.78 LMNA (0.33) CTDSP1LMNAASGR1
SCHEMBL11397616 0.75 ASGR1 (0.31) CTDSP1ASGR1
SCHEMBL14457875 0.74 CA2 (0.38) CTDSP1CA2MEN1LMNAKMT2A
SCHEMBL10077736 0.72 CTDSP1 (0.48) CTDSP1CA2LMNAKMT2ATSHR
SCHEMBL8743017 0.71 CA2 (0.36) CTDSP1CA2MEN1LMNAKMT2A

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
US-20150113860-A1 FUEL COMPOSITIONS COMPRISING HYDROPHOBIC DERIVATIVES OF GLYCERINE ENI S.P.A. (IT) 2015-04-30 US claimed
US-20150113860-A1 FUEL COMPOSITIONS COMPRISING HYDROPHOBIC DERIVATIVES OF GLYCERINE ENI S.P.A. (IT) 2015-04-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150113860-A1 FUEL COMPOSITIONS COMPRISING HYDROPHOBIC DERIVATIVES OF GLYCERINE GK, GRK5, DGKG CTDSP1 4358/4885CA2 3397/4885CYP2D6 1333/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.