SCHEMBL29978466

SCHEMBL29978466

N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 6/20 0.59
▸ ACE P12821 3/20 0.59
▸ ALDH1A1 P00352 2/20 0.59
▸ HPGD P15428 1/20 0.59
▸ MAPK1 P28482 1/20 0.59
▸ HSD17B10 Q99714 1/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ MAPT P10636 1/20 0.59
▸ ECE1 P42892 1/20 0.59
▸ BLM P54132 1/20 0.59
▸ NPEPPS P55786 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ MMP2 P08253 1/20 0.56
▸ OPRD1 P41143 4/20 0.48
▸ OPRM1 P35372 3/20 0.48
▸ OPRK1 P41145 1/20 0.48

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
SCHEMBL29576224 0.99 MME (0.60) MMEACEALDH1A1HPGDMAPK1
SCHEMBL10598700 0.90 FNTA (0.56) MMEACEALDH1A1HPGDMAPK1
SCHEMBL29350735 0.89 OPRD1 (0.58) MMEACEALDH1A1HPGDMAPK1
SCHEMBL29453929 0.89 FNTA (0.60) —
SCHEMBL29658873 0.88 MME (0.60) MMEACEALDH1A1HPGDMAPK1
SCHEMBL29658943 0.88 MME (0.60) MMEACEALDH1A1HPGDMAPK1
SCHEMBL14691645 0.87 MME (0.51) MMEACEALDH1A1HPGDMAPK1
SCHEMBL27906371 0.87 MME (0.51) MMEACEALDH1A1HPGDMAPK1
SCHEMBL31025582 0.87 MME (0.62) MMEACEMMP2
SCHEMBL31025651 0.87 MME (0.62) MMEACEMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12412749-B2 Etching method and plasma processing system TOKYO ELECTRON LIMITED (JP) 2025-09-09 — — US claimed
US-20230307243-A1 ETCHING METHOD AND PLASMA PROCESSING SYSTEM TOKYO ELECTRON LIMITED (JP) 2023-09-28 — — US claimed
CN-115408698-A Rust vulnerability detection method based on rust-IR2Graph and RGNN 内蒙古大学 2022-11-29 — — CN claimed
US-12412749-B2 Etching method and plasma processing system TOKYO ELECTRON LIMITED (JP) 2025-09-09 — — US disclosed
US-20250111889-A1 DE NOVO DESIGNED MACROCYCLIC OLIGOAMIDES UNIVERSITY OF WASHINGTON 2025-04-03 — — US disclosed
US-20230307243-A1 ETCHING METHOD AND PLASMA PROCESSING SYSTEM TOKYO ELECTRON LIMITED (JP) 2023-09-28 — — 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-20250111889-A1 DE NOVO DESIGNED MACROCYCLIC OLIGOAMIDES DHFR, CCNH, ODC1 MME 520/4885ACE 2373/4885ALDH1A1 4524/4885

“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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