SCHEMBL23839865

SCHEMBL23839865

C=CCOC(=O)NCCCC[C@H](NC)C(C)=O

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 5/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ ACHE P22303 5/20 0.35
▸ ERN1 O75460 2/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ FOLH1 Q04609 2/20 0.34
▸ CASP1 P29466 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
SCHEMBL23839866 1.00 TGM2 (0.36) TGM2ALDH1A1ACHEERN1BRD4
SCHEMBL15631792 0.89 TGM2 (0.43) TGM2FOLH1CASP1
SCHEMBL16174189 0.82 ACHE (0.42) ACHEFOLH1
SCHEMBL14962055 0.82 ACHE (0.37) ALDH1A1ACHEERN1BRD4CASP1
SCHEMBL23705401 0.79 TGM2 (0.52) TGM2FOLH1CASP1
SCHEMBL23705400 0.79 TGM2 (0.52) TGM2FOLH1CASP1
SCHEMBL19414915 0.79 TDP1 (0.36) TGM2ACHEERN1BRD4
SCHEMBL3676772 0.78 TGM2 (0.46) TGM2ACHEERN1
SCHEMBL24173419 0.78 ERN1 (0.37) TGM2ERN1BRD4FOLH1CASP1
SCHEMBL24023996 0.77 TGM2 (0.37) TGM2ACHEERN1BRD4CASP1

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-20230295260-A1 GLP RECEPTOR AGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2023-09-21 — — US disclosed
WO-2021186166-A1 GLP RECEPTOR AGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2021-09-23 — — WO disclosed
WO-2021186169-A1 ORAL GLP RECEPTOR AGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2021-09-23 — — 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 (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-20230295260-A1 GLP RECEPTOR AGONISTS GLP1R, GIPR, NPY4R TGM2 499/4885ALDH1A1 4025/4885ACHE 4105/4885

“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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