SCHEMBL20526772

SCHEMBL20526772

NC(=S)CC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.56
▸ TP53 P04637 3/20 0.56
▸ CASP3 P42574 3/20 0.53
▸ KMT2A Q03164 2/20 0.51
▸ MDM2 Q00987 5/20 0.48
▸ SLC17A5 Q9NRA2 1/20 0.47

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
SCHEMBL20526769 1.00 MDM4 (0.56) MDM4TP53CASP3KMT2AMDM2
SCHEMBL29401991 0.90 MDM4 (0.58) MDM4TP53CASP3KMT2AMDM2
SCHEMBL29370319 0.90 MDM4 (0.58) MDM4TP53CASP3KMT2AMDM2
SCHEMBL2309917 0.90 MDM4 (0.58) MDM4TP53CASP3KMT2AMDM2
SCHEMBL29908070 0.90 MDM4 (0.58) MDM4TP53CASP3KMT2AMDM2
SCHEMBL119451 0.90 MDM4 (0.58) MDM4TP53CASP3KMT2AMDM2
SCHEMBL119442 0.90 MDM4 (0.58) MDM4TP53CASP3KMT2AMDM2
SCHEMBL1486199 0.88 CASP3 (0.64) MDM4TP53CASP3KMT2AMDM2
SCHEMBL378041 0.88 CASP3 (0.64) MDM4TP53CASP3KMT2AMDM2
SCHEMBL378040 0.88 CASP3 (0.64) MDM4TP53CASP3KMT2AMDM2

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
EP-3609876-B1 COVALENT SMALL MOLECULE DCN1 INHIBITORS AND THERAPEUTIC METHODS USING THE SAME UNIV MICHIGAN REGENTS (US) 2022-03-30 — — EP disclosed
EP-3609876-A1 COVALENT SMALL MOLECULE DCN1 INHIBITORS AND THERAPEUTIC METHODS USING THE SAME The Regents of The University of Michigan (US) 2020-02-19 — — EP disclosed
WO-2018191199-A1 COVALENT SMALL MOLECULE DCN1 INHIBITORS AND THERAPEUTIC METHODS USING THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2018-10-18 — — WO disclosed
US-20180289677-A1 Covalent Small Molecule DCN1 Inhibitors and Therapeutic Methods Using the Same THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2018-10-11 — — 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-20180289677-A1 Covalent Small Molecule DCN1 Inhibitors and Therapeutic Methods Using the Same CAPNS1, DCLRE1A, DCUN1D2 MDM4 3809/4885TP53 2031/4885CASP3 1823/4885

“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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