SCHEMBL30992316

SCHEMBL30992316

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

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 8/20 0.38
▸ SIRT1 Q96EB6 7/20 0.38
▸ SIRT5 Q9NXA8 4/20 0.37
▸ SIRT3 Q9NTG7 3/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ SSTR3 P32745 1/20 0.36
▸ TGM2 P21980 1/20 0.36
▸ PTPN1 P18031 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
SCHEMBL30992310 1.00 SIRT2 (0.38) SIRT2SIRT1SIRT5SIRT3HTR2A
SCHEMBL30781664 0.93 SIRT5 (0.36) SIRT2SIRT1SIRT5SIRT3SSTR3
SCHEMBL23880502 0.88 MAP1LC3B (0.37) SIRT5HTR2ASSTR3PTPN1
SCHEMBL19432556 0.88 MAP1LC3B (0.37) SIRT5HTR2ASSTR3PTPN1
SCHEMBL23880537 0.88 MAP1LC3B (0.37) SIRT5HTR2ASSTR3PTPN1
SCHEMBL31035944 0.88 MAP1LC3B (0.37) SIRT5HTR2ASSTR3PTPN1
SCHEMBL29423538 0.87 MDM2 (0.39) SIRT2SIRT1SIRT5SIRT3HTR2A
SCHEMBL12094377 0.87 HTR2A (0.40) SIRT2SIRT1SIRT5SIRT3HTR2A
SCHEMBL12944195 0.87 HTR2A (0.40) SIRT2SIRT1SIRT5SIRT3HTR2A
SCHEMBL2734925 0.87 HTR2A (0.40) SIRT2SIRT1SIRT5SIRT3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250205348-A1 NOVEL PEPTIDIC LINKERS AND CRYPTOPHYCIN CONJUGATES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI (FR) 2025-06-26 — — US disclosed
US-11998611-B2 Cryptophycin antibody conjugates for the treatment of cancer SANOFI (FR) 2024-06-04 — — 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 (2 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-11998611-B2 Cryptophycin antibody conjugates for the treatment of cancer CLSPN, HCCS, INCENP SIRT2 2704/4885SIRT1 3253/4885SIRT5 2306/4885
US-20250205348-A1 NOVEL PEPTIDIC LINKERS AND CRYPTOPHYCIN CONJUGATES, THEIR PREPARATION AND THEIR THERAPEUTIC USE RPN1, CLSPN, FRG1 SIRT2 3306/4885SIRT1 2440/4885SIRT5 4188/4885

“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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