SCHEMBL25453024

SCHEMBL25453024

O=C(O)[C@@H]1CCCN(C(=O)CCC2CCCCC2)C1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
TP53 P04637 1/20 0.56
ITGB3 P05106 12/20 0.56
ITGA2B P08514 12/20 0.56
F2R P25116 10/20 0.56
HSD11B1 P28845 1/20 0.54
ALDH1A1 P00352 2/20 0.54
ATM Q13315 1/20 0.49

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
SCHEMBL17429918 0.88 ITGB3 (0.72) ITGB3ITGA2BF2RALDH1A1
SCHEMBL6538722 0.82 HPGD (0.52) MEN1KMT2AITGB3ITGA2BF2R
SCHEMBL7501858 0.82 HPGD (0.52) MEN1KMT2AITGB3ITGA2BF2R
SCHEMBL6538726 0.82 HPGD (0.52) MEN1KMT2AITGB3ITGA2BF2R
SCHEMBL5517503 0.81 HSD11B1 (0.70) MEN1KMT2ATP53HSD11B1ALDH1A1
SCHEMBL22602813 0.81 HSD11B1 (0.70) MEN1KMT2ATP53HSD11B1ALDH1A1
SCHEMBL3952911 0.81 HSD11B1 (0.70) MEN1KMT2ATP53HSD11B1ALDH1A1
SCHEMBL3664951 0.81 ALDH1A1 (0.50) MEN1KMT2AITGB3ITGA2BF2R
SCHEMBL25453023 0.80 ALDH1A1 (0.66) MEN1KMT2AHSD11B1ALDH1A1
SCHEMBL3455258 0.80 ALDH1A1 (0.66) MEN1KMT2AHSD11B1ALDH1A1

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-20230142546-A1 RADIOPHARMACEUTICALS AND COMPOSITION FOR THROMBUS IMAGING THE ASAN FOUNDATION (KR) 2023-05-11 US disclosed
US-20230129721-A1 STABILIZER FOR RADIOPHARMACEUTICALS AND RADIOPHARMACEUTICAL COMPOSITION COMPRISING THE SAME THE ASAN FOUNDATION (KR) 2023-04-27 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-20230142546-A1 RADIOPHARMACEUTICALS AND COMPOSITION FOR THROMBUS IMAGING SERPINC1, F3, F11 MEN1 16/4885KMT2A 2101/4885TP53 3544/4885
US-20230129721-A1 STABILIZER FOR RADIOPHARMACEUTICALS AND RADIOPHARMACEUTICAL COMPOSITION COMPRISING THE SAME GC, ADORA2B, TBCB MEN1 67/4885KMT2A 3950/4885TP53 2543/4885

“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.