SCHEMBL14645284

SCHEMBL14645284

[N-]=[N+]=NCCOCCOCCOCCN1C(=O)N=NC1=O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MGMT P16455 1/20 0.46
▸ MGLL Q99685 1/20 0.39
▸ ABCG2 Q9UNQ0 6/20 0.33
▸ CRBN Q96SW2 1/20 0.32
▸ GAA P10253 1/20 0.30
▸ OPRM1 P35372 1/20 0.30
▸ OPRD1 P41143 1/20 0.30
▸ OPRK1 P41145 1/20 0.30

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
SCHEMBL13695964 0.80 MGLL (0.67) MGMTMGLLABCG2CRBN
SCHEMBL26349168 0.80 MGMT (0.43) MGMTMGLLABCG2GAA
SCHEMBL27252888 0.80 MGLL (0.67) MGMTMGLLABCG2CRBN
SCHEMBL25280932 0.80 MGMT (0.43) MGMTMGLLABCG2CRBNGAA
SCHEMBL29009049 0.80 MGLL (0.67) MGMTMGLLABCG2CRBN
SCHEMBL25495610 0.80 MGLL (0.67) MGMTMGLLABCG2CRBN
SCHEMBL25495612 0.79 MGMT (0.42) MGMTMGLLABCG2
SCHEMBL18212282 0.77 MGMT (0.40) MGMTMGLLABCG2GAA
SCHEMBL17262434 0.77 MGMT (0.40) MGMTMGLLABCG2GAA
SCHEMBL30459733 0.75 MGMT (0.39) MGMTMGLLABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9149541-B2 Tyrosine ligation process NOVARTIS AG (CH) 2015-10-06 — — US disclosed
US-9149541-B2 Tyrosine ligation process NOVARTIS AG (CH) 2015-10-06 — — US disclosed
US-9149541-B2 Tyrosine ligation process NOVARTIS AG (CH) 2015-10-06 — — US disclosed
US-20140141034-A1 TYROSINE LIGATION PROCESS NOVARTIS AG (CH) 2014-05-22 — — US disclosed
US-20140141034-A1 TYROSINE LIGATION PROCESS NOVARTIS AG (CH) 2014-05-22 — — US disclosed
US-20140141034-A1 TYROSINE LIGATION PROCESS NOVARTIS AG (CH) 2014-05-22 — — US disclosed
EP-2729178-A1 TYROSINE LIGATION PROCESS Novartis AG (CH) 2014-05-14 — — EP disclosed
WO-2013009564-A1 TYROSINE LIGATION PROCESS NOVARTIS AG (CH) 2013-01-17 — — WO 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-20140141034-A1 TYROSINE LIGATION PROCESS ACP1, LTK, TTL MGMT 3036/4885MGLL 327/4885ABCG2 4680/4885

“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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