SCHEMBL22691097

SCHEMBL22691097

CC(C)C(NC(=O)COCCN=[N+]=[N-])C(=O)NC(CCCNC(N)=O)C(=O)Nc1ccc(CBr)cc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 10/20 0.42
▸ C3AR1 Q16581 1/20 0.37
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAP1LC3B Q9GZQ8 2/20 0.34
▸ ROCK2 O75116 1/20 0.34
▸ KLKB1 P03952 2/20 0.33
▸ IL23R Q5VWK5 1/20 0.32

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
SCHEMBL22691094 1.00 FURIN (0.42) FURINC3AR1HTTSMN1; SMN2MAP1LC3B
SCHEMBL17637465 0.98 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2MAP1LC3B
SCHEMBL22690491 0.98 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2MAP1LC3B
SCHEMBL17637464 0.92 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2MAP1LC3B
SCHEMBL22690514 0.92 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2MAP1LC3B
SCHEMBL28592858 0.92 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2MAP1LC3B
SCHEMBL28592862 0.92 FURIN (0.41) FURINC3AR1HTTSMN1; SMN2MAP1LC3B
SCHEMBL28604524 0.90 FURIN (0.41) FURINC3AR1
SCHEMBL28604515 0.90 FURIN (0.41) FURINC3AR1
SCHEMBL28650727 0.89 FURIN (0.39) FURINC3AR1HTTSMN1; SMN2MAP1LC3B

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 9 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
WO-2020236825-A2 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE NOVARTIS AG (CH) 2020-11-26 — — WO disclosed
WO-2020236817-A2 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE NOVARTIS AG (CH) 2020-11-26 — — 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 (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 FURIN 3583/4885C3AR1 3376/4885HTT 2963/4885
US-20230081720-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE MCL1, CD74, CD99 FURIN 3922/4885C3AR1 4036/4885HTT 3594/4885
US-20240042051-A1 MCL-1 INHIBITOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE MCL1, CD58, LENG8 FURIN 2649/4885C3AR1 2912/4885HTT 3986/4885

“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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