SCHEMBL13620101

SCHEMBL13620101

CCOCC1COC(C)(CO)O1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 1/20 0.37
CA2 P00918 1/20 0.35
CYP2D6 P10635 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
PDK1 Q15118 2/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL14457875 0.91 CA2 (0.38) CTDSP1CA2MEN1LMNAKMT2A
SCHEMBL16669702 0.84 CTDSP1 (0.38) CTDSP1CA2CYP2D6SLC6A2SLC6A4
SCHEMBL25691501 0.81 MEN1 (0.37) CTDSP1CA2MEN1LMNAKMT2A
SCHEMBL13620111 0.79 SPHK2 (0.32) CA2
SCHEMBL1786903 0.78 CA2 (0.54) CA2CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL1487288 0.78 CA2 (0.54) CA2CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL12967131 0.78 CA2 (0.54) CA2CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL24065927 0.77 CHRM2 (0.34) CTDSP1CA2MEN1LMNAKMT2A
SCHEMBL14342995 0.77 CHRM2 (0.34) CTDSP1CA2MEN1LMNAKMT2A
SCHEMBL14457149 0.76 CA2 (0.34) CTDSP1CA2

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-20090292093-A1 FLUORINATED COMPOUND AND FLUORINATED POLYMER ASAHI GLASS COMPANY, LIMITED (JP) 2009-11-26 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-20090292093-A1 FLUORINATED COMPOUND AND FLUORINATED POLYMER AFF2, RFC2, RFC3 CTDSP1 789/4885CA2 3315/4885CYP2D6 3616/4885

“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.