SCHEMBL25403202

SCHEMBL25403202

CC(C)(C)OC(=O)CN1CCOCCN(CC(=O)OC(C)(C)C)CCN(CC(=O)OC(C)(C)C)CCOCCN(CC(=O)OCc2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
POLB P06746 1/20 0.58
NPSR1 Q6W5P4 1/20 0.51
ALDH1A1 P00352 7/20 0.47
MAPT P10636 1/20 0.47
USP2 O75604 1/20 0.47
HTT P42858 1/20 0.47
TRPV4 Q9HBA0 1/20 0.47
EGFR P00533 2/20 0.46
LIPE Q05469 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL12004770 0.93 ALDH1A1 (0.49) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL15982318 0.93 ALDH1A1 (0.49) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL2811174 0.93 ALDH1A1 (0.49) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL25422192 0.93 ALDH1A1 (0.49) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL28519312 0.93 ALDH1A1 (0.49) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL1128242 0.89 MEN1 (0.71) MEN1KMT2APOLBNPSR1ALDH1A1
SCHEMBL16749989 0.88 HTT (0.46) MEN1KMT2APOLBALDH1A1HTT
SCHEMBL18840380 0.88 ALDH1A1 (0.45) MEN1KMT2APOLBALDH1A1SMN1; SMN2
Bromide SCHEMBL4656223 0.87 ALDH1A1 (0.44) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL18286738 0.86 ALDH1A1 (0.43) MEN1KMT2APOLBALDH1A1SMN1; SMN2

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-20230270892-A1 CHELATOR COMPOSITIONS FOR RADIOMETALS AND METHODS OF USING SAME TRIUMF INC. (CA) 2023-08-31 US disclosed
US-20230270892-A1 CHELATOR COMPOSITIONS FOR RADIOMETALS AND METHODS OF USING SAME TRIUMF INC. (CA) 2023-08-31 US disclosed
EP-4110768-A1 CHELATOR COMPOSITIONS FOR RADIOMETALS AND METHODS OF USING SAME Triumf Inc. (CA) 2023-01-04 EP 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-20230270892-A1 CHELATOR COMPOSITIONS FOR RADIOMETALS AND METHODS OF USING SAME RAE1, TFRC, SLC30A6 MEN1 214/4885KMT2A 2059/4885POLB 1895/4885

“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.