SCHEMBL16588609

SCHEMBL16588609

CCCCCCCCCCCCCC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](CO)NC(=O)CCCCCCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ DEGS1 O15121 1/20 0.40
▸ CNR2 P34972 4/20 0.40
▸ CERT1 Q9Y5P4 3/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ CNR1 P21554 2/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ CTSG P08311 1/20 0.39
▸ CTRB1 P17538 1/20 0.39
▸ CMA1 P23946 1/20 0.39
▸ EPHX2 P34913 1/20 0.39

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
SCHEMBL17035858 0.96 ALOX5 (0.41) SMN1; SMN2PRSS1CTSGCTRB1CMA1
SCHEMBL15281677 0.96 ALOX5 (0.41) SMN1; SMN2PRSS1CTSGCTRB1CMA1
SCHEMBL19827423 0.95 PRSS1 (0.42) MEN1KMT2ADEGS1CERT1SMN1; SMN2
SCHEMBL17035844 0.92 EPHX2 (0.47) DEGS1CNR2CNR1EPHX2
SCHEMBL15281659 0.89 CNR2 (0.50) MEN1KMT2ACNR2PRSS1CTSG
SCHEMBL19827331 0.89 MEN1 (0.53) MEN1KMT2ADEGS1PRSS1CTSG
SCHEMBL12632771 0.89 MEN1 (0.53) MEN1KMT2ADEGS1PRSS1CTSG
SCHEMBL15281661 0.89 MEN1 (0.53) MEN1KMT2ADEGS1PRSS1CTSG
SCHEMBL15281660 0.87 MEN1 (0.50) MEN1KMT2ADEGS1PRSS1CTSG
SCHEMBL16588596 0.81 MEN1 (0.42) MEN1KMT2ADEGS1PRSS1CTSG

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 5 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
US-20150238597-A1 CARBOHYDRATE-GLYCOLIPID CONJUGATE VACCINES MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-08-27 — — US disclosed
EP-2827899-B1 POLYSACCHARIDE ANTIGEN-GLYCOLIPID CONJUGATE VACCINES MAX PLANCK GES ZUR FÖRDERUNG DER WISSENSCHAFTEN E V (DE) 2015-08-05 — — EP 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 (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-20150238597-A1 CARBOHYDRATE-GLYCOLIPID CONJUGATE VACCINES STT3B, STT3A, DDOST MEN1 2616/4885KMT2A 2780/4885DEGS1 1219/4885
US-20160279224-A1 PROTEIN AND PEPTIDE-FREE SYNTHETIC VACCINES AGAINST STREPTOCOCCUS PNEUMONIAE TYPE 3 STT3A, DDOST, LGALS3BP MEN1 2043/4885KMT2A 3980/4885DEGS1 301/4885

“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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