SCHEMBL24178779

SCHEMBL24178779

CCCCCCCCCCCCN(CCCCCCCC)C(=O)COCC(=O)N(CCCCCCCC)CCCCCCCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.45
CA1 P00915 3/20 0.45
CA9 Q16790 3/20 0.45
CA2 P00918 1/20 0.45
CES2 O00748 5/20 0.44
MGLL Q99685 1/20 0.41
ZDHHC20 Q5W0Z9 2/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP8 P22894 1/20 0.39
DNM1 Q05193 2/20 0.39
KDM5A P29375 1/20 0.38
CES1 P23141 3/20 0.38

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
SCHEMBL29758628 1.00 CA12 (0.45) CA12CA1CA9CA2CES2
SCHEMBL935492 1.00 CA12 (0.45) CA12CA1CA9CA2CES2
SCHEMBL936147 1.00 CA12 (0.45) CA12CA1CA9CA2CES2
SCHEMBL26764119 1.00 CA12 (0.45) CA12CA1CA9CA2CES2
SCHEMBL3268168 1.00 CA12 (0.45) CA12CA1CA9CA2CES2
SCHEMBL24178687 1.00 CA12 (0.45) CA12CA1CA9CA2CES2
SCHEMBL29758625 0.98 CA12 (0.45) CA12CA1CA9CA2CES2
SCHEMBL21481160 0.98 CA12 (0.45) CA12CA1CA9CA2CES2
SCHEMBL23039655 0.98 CA12 (0.43) CA12CA1CA9CA2CES2
SCHEMBL24178778 0.96 CA12 (0.42) CA12CA1CA9CA2CES2

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-20230366059-A1 METHOD FOR SEPARATION OF ADJACENT LANTHANIDE ELEMENTS UT-BATTELLE, LLC 2023-11-16 US disclosed
US-20230366059-A1 METHOD FOR SEPARATION OF ADJACENT LANTHANIDE ELEMENTS UT-BATTELLE, LLC 2023-11-16 US disclosed
EP-4175941-A2 METHODS FOR SEPARATION AND RECOVERY OF RARE EARTH ELEMENTS FROM AQUEOUS SOLUTIONS USING DIGLYCOLAMIDE DERIVATIVES UT-Battelle, LLC (US) 2023-05-10 EP disclosed
WO-2022010759-A2 METHODS FOR SEPARATION AND RECOVERY OF RARE EARTH ELEMENTS FROM AQUEOUS SOLUTIONS USING DIGLYCOLAMIDE DERIVATIVES UT-BATTELLE, LLC (US) 2022-01-13 WO disclosed
WO-2022010758-A1 DIGLYCOLAMIDE DERIVATIVES FOR SEPARATION AND RECOVERY OF RARE EARTH ELEMENTS FROM AQUEOUS SOLUTIONS UT-BATTELLE, LLC (US) 2022-01-13 WO disclosed
US-20220002229-A1 DIGLYCOLAMIDE DERIVATIVES FOR SEPARATION AND RECOVERY OF RARE EARTH ELEMENTS FROM AQUEOUS SOLUTIONS UT-BATTELLE, LLC 2022-01-06 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-20220002229-A1 DIGLYCOLAMIDE DERIVATIVES FOR SEPARATION AND RECOVERY OF RARE EARTH ELEMENTS FROM AQUEOUS SOLUTIONS GNE, GALE, ARGLU1 CA12 834/4885CA1 414/4885CA9 489/4885

“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.