SCHEMBL16588616

SCHEMBL16588616

CCCCOCC1O[C@@H](SCC)[C@@H](OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)[C@@H]1O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 7/20 0.50
▸ LGALS9 O00182 6/20 0.50
▸ LGALS1 P09382 6/20 0.50
▸ LGALS7; LGALS7B P47929 5/20 0.50
▸ PTPN1 P18031 5/20 0.40
▸ LGALS8 O00214 3/20 0.40
▸ SELP P16109 1/20 0.35
▸ BCHE P06276 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ P2RY11 Q96G91 1/20 0.34
▸ LGALS4 P56470 1/20 0.33
▸ ABCB1 P08183 1/20 0.33
▸ CTSK P43235 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL19481407 1.00 LGALS3 (0.50) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL17636499 1.00 LGALS3 (0.50) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL16588617 0.92 LGALS9 (0.44) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL8271922 0.90 LGALS9 (0.43) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL8271047 0.90 LGALS9 (0.43) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL16326716 0.90 LGALS9 (0.43) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL17636482 0.88 LGALS9 (0.43) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL16581558 0.87 LGALS9 (0.51) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL18239534 0.86 LGALS9 (0.40) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL12848097 0.86 LGALS9 (0.55) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160279224-A1 PROTEIN AND PEPTIDE-FREE SYNTHETIC VACCINES AGAINST STREPTOCOCCUS PNEUMONIAE TYPE 3 MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2016-09-29 — — US disclosed
WO-2015040140-A1 PROTEIN AND PEPTIDE-FREE SYNTHETIC VACCINES AGAINST STREPTOCOCCUS PNEUMONIAE TYPE 3 MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-03-26 — — WO disclosed
EP-2851092-A1 Protein and peptide-free synthetic vaccines against streptococcus pneumoniae type 3 Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-03-25 — — EP 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-20160279224-A1 PROTEIN AND PEPTIDE-FREE SYNTHETIC VACCINES AGAINST STREPTOCOCCUS PNEUMONIAE TYPE 3 STT3A, DDOST, LGALS3BP LGALS3 9/4885LGALS9 75/4885LGALS1 67/4885

“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.

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