SCHEMBL12847445

SCHEMBL12847445

CC(C)N(C)CCCN(CCO)CCO

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
EGFR P00533 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
RAD52 P43351 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL12847436 0.86 MAPT (0.39) MAPTMAPK1SMN1; SMN2
SCHEMBL1403972 0.80
SCHEMBL27418812 0.80 MAPT (0.35) MAPTMEN1ALDH1A1KMT2A
SCHEMBL188592 0.80
SCHEMBL5715676 0.80 MEN1 (0.32) MEN1ALDH1A1KMT2A
SCHEMBL9641416 0.79 MEN1 (0.39) MAPTMEN1ALDH1A1EGFRLMNA
SCHEMBL23116984 0.78 MAPT (0.33) MAPTMAPK1NPSR1
SCHEMBL1404024 0.78 MAPT (0.35) MAPTMEN1ALDH1A1LMNAKMT2A
SCHEMBL6382395 0.77 MAPT (0.39) MAPTMEN1ALDH1A1EGFRLMNA
SCHEMBL24579002 0.77 MAPT (0.39) MAPTMEN1ALDH1A1EGFRLMNA

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
WO-2022125589-A1 LIPIDOID COMPOSITIONS AND METHODS OF USE THEREOF TRUSTEES OF TUFTS COLLEGE (US) 2022-06-16 WO disclosed
US-20110052673-A1 THERAPEUTIC COMPOSITIONS SHIRE HUMAN GENETIC THERAPIES, INC. 2011-03-03 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-20110052673-A1 THERAPEUTIC COMPOSITIONS PHOSPHO1, SGMS1, APOB MAPT 513/4885MEN1 718/4885ALDH1A1 2111/4885

“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.