SCHEMBL25826704

SCHEMBL25826704

CC(C)CCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(=O)C(C)(C)C)cc1)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 6/20 0.37
▸ SIRT1 Q96EB6 5/20 0.37
▸ MAP1LC3B Q9GZQ8 2/20 0.36
▸ SIRT5 Q9NXA8 2/20 0.36
▸ SIRT3 Q9NTG7 3/20 0.35
▸ FAP Q12884 3/20 0.35
▸ FURIN P09958 2/20 0.35
▸ NPY1R P25929 1/20 0.35
▸ NPY4R P50391 1/20 0.35
▸ HTT P42858 1/20 0.34

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
SCHEMBL20616684 0.94 SIRT5 (0.38) SIRT2SIRT1MAP1LC3BSIRT5SIRT3
SCHEMBL20616683 0.94 SIRT5 (0.38) SIRT2SIRT1MAP1LC3BSIRT5SIRT3
SCHEMBL26254328 0.94 MAP1LC3B (0.37) SIRT2SIRT1MAP1LC3BSIRT5SIRT3
SCHEMBL26254329 0.92 SIRT2 (0.36) SIRT2SIRT1MAP1LC3BSIRT5SIRT3
SCHEMBL25826705 0.91 FURIN (0.37) SIRT2SIRT1MAP1LC3BSIRT5SIRT3
SCHEMBL26257331 0.91 SIRT2 (0.36) SIRT2SIRT1MAP1LC3BSIRT5SIRT3
SCHEMBL19387330 0.91 SIRT5 (0.38) SIRT2SIRT1MAP1LC3BSIRT5SIRT3
SCHEMBL18909058 0.90 FAP (0.41) SIRT2SIRT1MAP1LC3BSIRT5SIRT3
SCHEMBL19708234 0.90 FAP (0.41) SIRT2SIRT1MAP1LC3BSIRT5SIRT3
SCHEMBL20467807 0.90 FAP (0.41) SIRT2SIRT1MAP1LC3BSIRT5SIRT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240207412-A1 DIELS-ALDER CONJUGATION METHODS REGENERON PHARMACEUTICALS, INC. (US) 2024-06-27 — — US disclosed
US-20230285581-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2023-09-14 — — US disclosed
US-11701427-B2 Diels-alder conjugation methods REGENERON PHARMACEUTICALS, INC. (US) 2023-07-18 — — 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 (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-20240207412-A1 DIELS-ALDER CONJUGATION METHODS GLUL, TGM2, GLS SIRT2 1025/4885SIRT1 1357/4885MAP1LC3B 1067/4885
US-11701427-B2 Diels-alder conjugation methods GLUL, TGM2, GLS SIRT2 1025/4885SIRT1 1357/4885MAP1LC3B 1067/4885
US-20230285581-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF ASGR1, CUTA, SRPRA SIRT2 4366/4885SIRT1 3932/4885MAP1LC3B 3273/4885

“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.

Send feedback