SCHEMBL8588339

SCHEMBL8588339

COC1C(O)[C@H](n2cc(I)c(=O)[nH]c2=O)O[C@@H]1COC(C)C

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PYGM P11217 3/20 0.56
P2RY6 Q15077 8/20 0.52
P2RY14 Q15391 3/20 0.52
TK1 P04183 1/20 0.43
DNPH1 O43598 1/20 0.41
TK2 O00142 2/20 0.41

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
SCHEMBL14712700 1.00 PYGM (0.56) PYGMP2RY6P2RY14TK1DNPH1
SCHEMBL1699647 0.92 PYGM (0.56) PYGMP2RY6P2RY14TK1DNPH1
SCHEMBL2614693 0.92 PYGM (0.56) PYGMP2RY6P2RY14TK1DNPH1
SCHEMBL12240330 0.92 PYGM (0.56) PYGMP2RY6P2RY14TK1DNPH1
SCHEMBL15336921 0.89 PYGM (0.61) PYGMP2RY6P2RY14TK1DNPH1
SCHEMBL10163761 0.89 PYGM (0.61) PYGMP2RY6P2RY14TK1DNPH1
SCHEMBL13184452 0.88 PYGM (0.56) PYGMP2RY6DNPH1TK2
SCHEMBL20072701 0.80 TK2 (0.47) PYGMTK2
SCHEMBL24452332 0.80 PYGM (0.56) PYGMP2RY6P2RY14TK1TK2
SCHEMBL15367277 0.79 PYGM (0.72) PYGMP2RY6P2RY14TK1TK2

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-20120128760-A1 LIPID COMPOSITIONS ALNYLAM PHARMACEUTICALS, INC. (US) 2012-05-24 US disclosed
US-20100222417-A1 Compostions and methods for enhancing oligonucleotide delivery across and into epithelial tissues ALNYLAM PHARMACEUTICALS (US) 2010-09-02 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 (2 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-20100222417-A1 Compostions and methods for enhancing oligonucleotide delivery across and into epithelial tissues RNASE1, MTREX, FABP2 PYGM 2934/4885P2RY6 3884/4885P2RY14 4006/4885
US-20120128760-A1 LIPID COMPOSITIONS SGMS1, SGMS2, LIPA PYGM 4222/4885P2RY6 4671/4885P2RY14 4716/4885

“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.