SCHEMBL23705400

SCHEMBL23705400

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

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 11/20 0.52
FOLH1 Q04609 4/20 0.46
CASP1 P29466 4/20 0.44
SIRT2 Q8IXJ6 1/20 0.42
SIRT1 Q96EB6 1/20 0.42

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
SCHEMBL23705401 1.00 TGM2 (0.52) TGM2FOLH1CASP1SIRT2SIRT1
SCHEMBL12737519 0.95 TGM2 (0.48) TGM2FOLH1CASP1
SCHEMBL16116011 0.89 SMN1; SMN2 (0.49) TGM2FOLH1
SCHEMBL16116008 0.89 SMN1; SMN2 (0.49) TGM2FOLH1
SCHEMBL16486872 0.89 MEN1 (0.52) TGM2
SCHEMBL29773945 0.89 MEN1 (0.52) TGM2
SCHEMBL16486871 0.89 MEN1 (0.52) TGM2
SCHEMBL15631792 0.87 TGM2 (0.43) TGM2FOLH1CASP1
SCHEMBL12082261 0.87 FOLH1 (0.67) TGM2FOLH1SIRT2SIRT1
SCHEMBL25356549 0.84 MEN1 (0.53) TGM2

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-20240350649-A1 TREATMENT AND DIAGNOSIS OF IMMUNE DISORDERS RELATING TO ABERRANT IMMUNE CELLS OCTAGON THERAPEUTICS, INC. 2024-10-24 US disclosed
EP-4096673-A1 MODULATION OF IMMUNE CELLS Octagon Therapeutics Inc. (US) 2022-12-07 EP disclosed
WO-2021155277-A1 MODULATION OF IMMUNE CELLS OCTAGON THERAPEUTICS, INC. (US) 2021-08-05 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-20240350649-A1 TREATMENT AND DIAGNOSIS OF IMMUNE DISORDERS RELATING TO ABERRANT IMMUNE CELLS CD74, SERPINA6, CD2BP2 TGM2 393/4885FOLH1 752/4885CASP1 3628/4885

“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.