SCHEMBL3197099

SCHEMBL3197099

COC(=O)NCCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 4/20 0.54
▸ MDM4 O15151 2/20 0.54
▸ TP53 P04637 2/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ TLR2 O60603 2/20 0.54
▸ CASP3 P42574 1/20 0.52

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
SCHEMBL29528781 0.94 KMT2A (0.60) MDM2MDM4TP53KMT2ATLR2
SCHEMBL178805 0.94 KMT2A (0.60) MDM2MDM4TP53KMT2ATLR2
SCHEMBL29401303 0.94 KMT2A (0.60) MDM2MDM4TP53KMT2ATLR2
SCHEMBL178804 0.94 KMT2A (0.60) MDM2MDM4TP53KMT2ATLR2
SCHEMBL3487948 0.94 KMT2A (0.60) MDM2MDM4TP53KMT2ATLR2
SCHEMBL26310750 0.92 KMT2A (0.59) MDM2MDM4TP53KMT2ATLR2
SCHEMBL25357184 0.91 MDM4 (0.54) MDM2MDM4TP53KMT2ATLR2
SCHEMBL31210302 0.91 MDM4 (0.54) MDM2MDM4TP53KMT2ATLR2
SCHEMBL25357189 0.91 MDM4 (0.54) MDM2MDM4TP53KMT2ATLR2
SCHEMBL30385460 0.89 MDM2 (0.57) MDM2MDM4TP53KMT2ATLR2

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-7662960-B2 Beta-strand mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2010-02-16 — — US disclosed
EP-1646633-B1 BETA-STRAND MIMETICS CHOONGWAE PHARMA CORP (KR) 2009-04-15 — — EP disclosed
EP-1646633-A1 BETA-STRAND MIMETICS AND METHOD RELATING THERETO Choongwae Pharma Corporation (KR) 2006-04-19 — — EP disclosed
WO-2004108731-A1 BETA-STRAND MIMETICS AND METHOD RELATING THERETO CHOONGWAE PHARMA CORPORATION (KR) 2004-12-16 — — WO disclosed
US-20040053331-A1 Beta-strand mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2004-03-18 — — 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 (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-20040053331-A1 Beta-strand mimetics and method relating thereto BIRC5, BIRC7, XIAP MDM2 247/4885MDM4 643/4885TP53 88/4885

“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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