SCHEMBL5221342

SCHEMBL5221342

CCCC1(NC(C)=O)CCCC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CETP P11597 5/20 0.36
MME P08473 1/20 0.36
P2RX7 Q99572 1/20 0.34
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30

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
SCHEMBL5216206 0.98 CETP (0.38) CETPMMEP2RX7HTTLMNA
SCHEMBL23367152 0.96 MME (0.33) CETPMMEP2RX7HTTPOLB
SCHEMBL23083832 0.91 POLB (0.32) POLBALDH1A1
SCHEMBL13204902 0.86 CETP (0.40) CETPMMEP2RX7CYP4F2CYP4A11
SCHEMBL13204897 0.85 CETP (0.42) CETPMMEP2RX7HTTCYP4F2
SCHEMBL13204901 0.85 CETP (0.42) CETPMMEP2RX7HTTCYP4F2
SCHEMBL7724887 0.82 CYP4F2 (0.36) MMEP2RX7HTTPOLBALDH1A1
SCHEMBL5220339 0.81 HTT (0.38) CETPMMEP2RX7HTTLMNA
SCHEMBL15495270 0.80 KDM4E (0.34) LMNAPOLBALDH1A1
SCHEMBL976812 0.78 MME (0.44) MMEP2RX7HTTALDH1A1CYP4F2

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-7253198-B2 Hydroxyethylamine derivatives for the treatment of Alzheimer's disease GLAXO GROUP LIMITED (GB) 2007-08-07 US disclosed
EP-1567488-B1 HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE GLAXO GROUP LTD (GB) 2007-02-21 EP disclosed
US-20060025459-A1 Hydroxyethylamine derivatives for the treatment of alzheimer's disease GLAXO GROUP LIMITED (GB) 2006-02-02 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-20060025459-A1 Hydroxyethylamine derivatives for the treatment of alzheimer's disease BACE2, PSEN2, BACE1 CETP 1041/4885MME 9/4885P2RX7 3420/4885

“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.