SCHEMBL7583524

SCHEMBL7583524

CO[C@H]1[C@H](OCc2ccccc2)[C@@H](NC(C)=O)[C@@H](OCc2ccccc2)O[C@@H]1COCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
TP53 P04637 2/20 0.51
MDM2 Q00987 2/20 0.51
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.49
MDM4 O15151 1/20 0.49
HSP90AA1 P07900 1/20 0.49
HSP90AB1 P08238 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
GJB2 P29033 1/20 0.48
NT5E P21589 1/20 0.48
PTPN1 P18031 7/20 0.47
CDC25B P30305 5/20 0.47
SSTR1 P30872 1/20 0.47
SSTR2 P30874 1/20 0.47
SSTR4 P31391 1/20 0.47
SSTR3 P32745 1/20 0.47
SSTR5 P35346 1/20 0.47
PTPN2 P17706 3/20 0.46
PTPN6 P29350 2/20 0.46

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
SCHEMBL13491599 1.00 POLB (0.52) POLBTP53MDM2LMNAKMT2A
SCHEMBL5840884 0.96 TP53 (0.55) POLBTP53MDM2LMNAKMT2A
SCHEMBL5840927 0.96 TP53 (0.55) POLBTP53MDM2LMNAKMT2A
SCHEMBL16967451 0.96 TP53 (0.55) POLBTP53MDM2LMNAKMT2A
SCHEMBL15514084 0.96 TP53 (0.55) POLBTP53MDM2LMNAKMT2A
SCHEMBL23705291 0.94 TP53 (0.53) POLBTP53MDM2LMNAKMT2A
SCHEMBL7153092 0.94 TP53 (0.53) POLBTP53MDM2LMNAKMT2A
SCHEMBL7153085 0.94 TP53 (0.53) POLBTP53MDM2LMNAKMT2A
SCHEMBL7582210 0.93 TP53 (0.55) POLBTP53MDM2LMNAKMT2A
SCHEMBL11173059 0.92 TP53 (0.52) POLBTP53MDM2LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020137791-A1 NEURAMINIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR MEDICAL USE SANKYO COMPANY, LIMITED (JP) 2002-09-26 US disclosed
US-6340702-B1 SIALIDASE INHIBITORS; ANTIVIRAL COMPOUNDS SANKYO COMPANY, LIMITED (JP) 2002-01-22 US disclosed
EP-0823428-B1 Neuraminic acid derivatives, their preparation and their medical use SANKYO CO (JP) 2002-01-02 EP disclosed
EP-0823428-A2 Neuraminic acid derivatives, their preparation and their medical use SANKYO COMPANY LIMITED (JP) 1998-02-11 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-20020137791-A1 NEURAMINIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR MEDICAL USE NEU1, NEU3, NEU2 POLB 1576/4885TP53 4767/4885MDM2 4193/4885

“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.