SCHEMBL29423538

SCHEMBL29423538

CC(C)C(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)Nc1ccc(COC(=O)Oc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 1/20 0.39
▸ SIRT2 Q8IXJ6 7/20 0.39
▸ SIRT1 Q96EB6 6/20 0.39
▸ SIRT3 Q9NTG7 3/20 0.39
▸ HTR2A P28223 1/20 0.38
▸ SIRT5 Q9NXA8 2/20 0.38
▸ TGM2 P21980 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ PSMB8 P28062 1/20 0.37
▸ PSMB9 P28065 1/20 0.37
▸ PSMB5 P28074 1/20 0.37
▸ KLK7 P49862 1/20 0.37
▸ KLK5 Q9Y337 1/20 0.37
▸ SSTR3 P32745 1/20 0.36

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
SCHEMBL17541276 0.94 PTPN1 (0.38) MDM2SIRT2SIRT1SIRT3SIRT5
SCHEMBL17550383 0.94 PTPN1 (0.38) MDM2SIRT2SIRT1SIRT3SIRT5
SCHEMBL31726486 0.93 PTPN1 (0.37) MDM2SIRT2SIRT1SIRT3SIRT5
SCHEMBL17541309 0.92 KLK7 (0.38) MDM2SIRT2SIRT1SIRT3PSMB8
SCHEMBL2734925 0.90 HTR2A (0.40) SIRT2SIRT1SIRT3HTR2ASIRT5
SCHEMBL12094377 0.90 HTR2A (0.40) SIRT2SIRT1SIRT3HTR2ASIRT5
SCHEMBL12944195 0.90 HTR2A (0.40) SIRT2SIRT1SIRT3HTR2ASIRT5
SCHEMBL19731720 0.90 HTR2A (0.40) SIRT2SIRT1SIRT3HTR2ASIRT5
SCHEMBL13830646 0.90 HTR2A (0.40) SIRT2SIRT1SIRT3HTR2ASIRT5
SCHEMBL29579452 0.90 HTR2A (0.40) SIRT2SIRT1SIRT3HTR2ASIRT5

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
EP-3972649-B1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE NOVARTIS AG (CH) 2026-05-13 — — EP disclosed
US-20240042051-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE LES LABORATOIRES SERVIER (FR) 2024-02-08 — — US disclosed
EP-4251208-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE Novartis AG (CH) 2023-10-04 — — EP disclosed
US-20230092679-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2023-03-23 — — US disclosed
US-20230081720-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2023-03-16 — — US disclosed
WO-2022115451-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE NOVARTIS AG (CH) 2022-06-02 — — WO disclosed
EP-3972651-A2 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE Novartis AG (CH) 2022-03-30 — — EP disclosed
EP-3972649-A2 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE Novartis AG (CH) 2022-03-30 — — 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 (3 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-20230092679-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE MCL1, BCL9, BAK1 MDM2 528/4885SIRT2 2468/4885SIRT1 1706/4885
US-20230081720-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE MCL1, CD74, CD99 MDM2 533/4885SIRT2 3411/4885SIRT1 3424/4885
US-20240042051-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE MCL1, CD58, LENG8 MDM2 1619/4885SIRT2 3246/4885SIRT1 3214/4885

“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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