SCHEMBL4364564

SCHEMBL4364564

CCOC(=O)CN1CCN(/C(=C\C(=O)O)C(=O)O)CCN(CC(=O)OCC)Cc2cccc(n2)C1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.42
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 6/20 0.40
MEN1 O00255 2/20 0.40
ATM Q13315 1/20 0.40
MAPT P10636 1/20 0.40
BACE1 P56817 1/20 0.37
HTR1A P08908 1/20 0.36
HTR2C P28335 1/20 0.36
TSHR P16473 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL4364578 1.00 KDM4E (0.42) KDM4EKMT2AALDH1A1MEN1ATM
SCHEMBL4362890 0.85 ALDH1A1 (0.45) KDM4EKMT2AALDH1A1MEN1ATM
SCHEMBL12342861 0.82 ALDH1A1 (0.38) KDM4EKMT2AALDH1A1MEN1ATM
SCHEMBL9217160 0.79 LMNA (0.48) KMT2AALDH1A1MEN1TSHR
SCHEMBL12342818 0.78 ALDH1A1 (0.49) KDM4EKMT2AALDH1A1MEN1ATM
SCHEMBL18911326 0.77 MEN1 (0.46) KDM4EKMT2AALDH1A1MEN1TSHR
SCHEMBL12342819 0.77 MEN1 (0.44) KDM4EKMT2AALDH1A1MEN1MAPT
SCHEMBL4359497 0.76 MEN1 (0.41) KMT2AALDH1A1MEN1MAPTBACE1
SCHEMBL4359522 0.74 BACE1 (0.39) KMT2AALDH1A1MEN1MAPTBACE1
SCHEMBL12342862 0.74 MEN1 (0.38) KMT2AALDH1A1MEN1MAPTBACE1

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-8268810-B2 Lipophilic chelates and their use in imaging GUERBET (FR) 2012-09-18 US disclosed
US-20090214441-A1 Lipophilic Chelates and Their Use in Imaging GUERBET (FR) 2009-08-27 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 (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-20090214441-A1 Lipophilic Chelates and Their Use in Imaging SLC40A1, TSPO, SLC47A2 KDM4E 1946/4885KMT2A 1704/4885ALDH1A1 2637/4885

“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.