SCHEMBL30874648

SCHEMBL30874648

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCCCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 4/20 0.41
▸ TPSAB1 Q15661 1/20 0.38
▸ SIRT5 Q9NXA8 1/20 0.37
▸ SIRT2 Q8IXJ6 6/20 0.37
▸ SIRT1 Q96EB6 5/20 0.37
▸ PTPN1 P18031 2/20 0.36
▸ SIRT3 Q9NTG7 3/20 0.35

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
SCHEMBL30992313 0.92 CASP3 (0.40) TLR2SIRT5SIRT2SIRT1SIRT3
SCHEMBL21738670 0.92 CASP3 (0.40) TLR2SIRT5SIRT2SIRT1SIRT3
SCHEMBL21738589 0.92 CASP3 (0.40) TLR2SIRT5SIRT2SIRT1SIRT3
SCHEMBL30781796 0.90 TLR2 (0.46) TLR2TPSAB1SIRT5SIRT2SIRT1
SCHEMBL23880545 0.89 TLR2 (0.39) TLR2TPSAB1PTPN1
SCHEMBL30509100 0.89 TLR2 (0.39) TLR2TPSAB1PTPN1
SCHEMBL31035902 0.89 TLR2 (0.39) TLR2TPSAB1PTPN1
SCHEMBL84146 0.88 TLR2 (0.39) TLR2TPSAB1PTPN1
SCHEMBL27213335 0.88 EPOR (0.35) SIRT5SIRT2SIRT1
SCHEMBL30781664 0.88 SIRT5 (0.36) TLR2TPSAB1SIRT5SIRT2SIRT1

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
EP-4548937-A1 ANTIBODY-DRUG COMPLEX Eisai R&D Management Co., Ltd. (JP) 2025-05-07 — — EP disclosed
US-20240148895-A1 ANTIBODY-DRUG CONJUGATE EISAI R&D MANAGEMENT CO., LTD. (JP) 2024-05-09 — — 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 (1 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-20240148895-A1 ANTIBODY-DRUG CONJUGATE ANTXR2, FCGR1A, HAX1 TLR2 1069/4885TPSAB1 1343/4885SIRT5 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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