SCHEMBL21437116

SCHEMBL21437116

CC(C)C(N)C(=O)NC(CCCCN)C(=O)NCC(=O)NCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NMT2 O60551 1/20 0.44
▸ NMT1 P30419 1/20 0.44
▸ SIRT6 Q8N6T7 1/20 0.41
▸ SIRT1 Q96EB6 1/20 0.41
▸ GLO1 Q04760 1/20 0.40
▸ PTGS1 P23219 1/20 0.39
▸ GSTK1 Q9Y2Q3 1/20 0.39
▸ FOLH1 Q04609 1/20 0.38
▸ ITGB3 P05106 1/20 0.38
▸ ITGA2B P08514 1/20 0.38
▸ DPP4 P27487 2/20 0.37
▸ DPP8 Q6V1X1 2/20 0.37
▸ DPP9 Q86TI2 2/20 0.37
▸ DPP7 Q9UHL4 2/20 0.37
▸ FAP Q12884 1/20 0.37
▸ CPB2 Q96IY4 2/20 0.36
▸ SLC6A5 Q9Y345 1/20 0.36
▸ FURIN P09958 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 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
SCHEMBL29714775 1.00 NMT2 (0.44) NMT2NMT1SIRT6SIRT1GLO1
SCHEMBL29590365 0.95 SIRT6 (0.45) NMT2NMT1SIRT6SIRT1GLO1
SCHEMBL29388582 0.86 SIRT6 (0.44) NMT2NMT1SIRT6SIRT1GLO1
SCHEMBL30537468 0.85 ERAP2 (0.45) NMT2NMT1SIRT6SIRT1GLO1
SCHEMBL29569500 0.85 PTGS1 (0.43) NMT2NMT1SIRT6SIRT1GLO1
SCHEMBL29569342 0.85 PTGS1 (0.43) NMT2NMT1SIRT6SIRT1GLO1
SCHEMBL29569082 0.85 PTGS1 (0.43) NMT2NMT1SIRT6SIRT1GLO1
SCHEMBL29871873 0.84 SIRT6 (0.58) NMT2NMT1SIRT6SIRT1GLO1
SCHEMBL31099442 0.84 SIRT6 (0.47) NMT2NMT1SIRT6SIRT1GLO1
SCHEMBL29531200 0.84 SIRT6 (0.47) NMT2NMT1SIRT6SIRT1GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220193069-A1 CAMPTOTHECIN PEPTIDE CONJUGATES SEAGEN INC (US) 2022-06-23 — — US claimed
EP-3773736-A1 CAMPTOTHECIN PEPTIDE CONJUGATES Seagen Inc. (US) 2021-02-17 — — EP claimed
US-20190343828-A1 CAMPTOTHECIN PEPTIDE CONJUGATES SEATTLE GENETICS, INC. (US) 2019-11-14 — — US claimed
WO-2019195665-A1 CAMPTOTHECIN PEPTIDE CONJUGATES SEATTLE GENETICS, INC. (US) 2019-10-10 — — WO claimed
WO-2024129756-A1 SITE-SPECIFIC ENGINEERED CYSTEINE ANTIBODY DRUG CONJUGATES SEAGEN INC. (US) 2024-06-20 — — WO disclosed
US-20240123080-A1 CYTOTOXIC COMPOUNDS AND CONJUGATES THEREOF SEAGEN INC. 2024-04-18 — — US disclosed
WO-2024036329-A2 CYTOTOXIC COMPOUNDS AND CONJUGATES THEREOF SEAGEN INC. (US) 2024-02-15 — — WO disclosed
EP-4321522-A1 CYTOTOXIC COMPOUNDS AND CONJUGATES THEREOF Seagen Inc. (US) 2024-02-14 — — EP disclosed
US-20230381321-A1 CAMPTOTHECIN CONJUGATES SEAGEN INC. 2023-11-30 — — US disclosed
WO-2023178289-A2 CAMPTOTHECIN CONJUGATES SEAGEN INC. (US) 2023-09-21 — — WO disclosed
US-20220193069-A1 CAMPTOTHECIN PEPTIDE CONJUGATES SEAGEN INC (US) 2022-06-23 — — US disclosed
EP-3773736-A1 CAMPTOTHECIN PEPTIDE CONJUGATES Seagen Inc. (US) 2021-02-17 — — EP disclosed
US-20190343828-A1 CAMPTOTHECIN PEPTIDE CONJUGATES SEATTLE GENETICS, INC. (US) 2019-11-14 — — US disclosed
WO-2019195665-A1 CAMPTOTHECIN PEPTIDE CONJUGATES SEATTLE GENETICS, INC. (US) 2019-10-10 — — 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 (4 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-20230381321-A1 CAMPTOTHECIN CONJUGATES DCLRE1A, TOP2A, PAICS NMT2 566/4885NMT1 617/4885SIRT6 3101/4885
US-20220193069-A1 CAMPTOTHECIN PEPTIDE CONJUGATES VIP, DCLRE1A, UACA NMT2 104/4885NMT1 94/4885SIRT6 2650/4885
US-20190343828-A1 CAMPTOTHECIN PEPTIDE CONJUGATES VIP, DCLRE1A, UACA NMT2 104/4885NMT1 94/4885SIRT6 2650/4885
US-20240123080-A1 CYTOTOXIC COMPOUNDS AND CONJUGATES THEREOF AURKC, AURKB, AURKA NMT2 570/4885NMT1 479/4885SIRT6 1421/4885

“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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