SCHEMBL24434611

SCHEMBL24434611

CC(C)C(C)c1ccncc1OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.48
ALDH1A1 P00352 2/20 0.45
POLB P06746 1/20 0.45
ABCB1 P08183 1/20 0.44
LMNA P02545 2/20 0.43
SGMS2 Q8NHU3 2/20 0.43
HTR1A P08908 1/20 0.43
DRD2 P14416 1/20 0.43
MAPK1 P28482 2/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
IKBKB O14920 2/20 0.42
LTA4H P09960 1/20 0.42
MAPK14 Q16539 1/20 0.42
KDM4C Q9H3R0 1/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL28409918 0.85 LMNA (0.49) AOC3ALDH1A1POLBABCB1LMNA
SCHEMBL23046945 0.81 MAPT (0.55) ALDH1A1LMNASGMS2HTR1ADRD2
SCHEMBL30150617 0.77 ABCB1 (0.54) AOC3ALDH1A1POLBABCB1LMNA
SCHEMBL24435135 0.77 ABCB1 (0.48) AOC3ALDH1A1POLBABCB1LMNA
SCHEMBL27557972 0.75 LMNA (0.53) AOC3ALDH1A1ABCB1LMNAHTR1A
Ammonia Solution, Strong SCHEMBL28403781 0.75 MAPT (0.51) AOC3ALDH1A1POLBABCB1LMNA
SCHEMBL28412523 0.74 ADRB2 (0.45) AOC3ALDH1A1POLBLMNASGMS2
SCHEMBL20819360 0.74 ADRB2 (0.45) AOC3ALDH1A1POLBLMNASGMS2
SCHEMBL20819346 0.74 ADRB2 (0.45) AOC3ALDH1A1POLBLMNASGMS2
SCHEMBL26272364 0.74 CA12 (0.40) ALDH1A1POLBCYP19A1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220153732-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-05-19 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-20220153732-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G AOC3 4061/4885ALDH1A1 4817/4885POLB 3636/4885

“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.