SCHEMBL9089933

SCHEMBL9089933

CCOC(=O)c1nccc2c(C)c3c(cc12)c1cc(OC)ccc1n3C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.54
ACHE P22303 1/20 0.54
ELANE P08246 2/20 0.48
GABRG2 P18507 4/20 0.44
GABRB3 P28472 4/20 0.44
GABRA5 P31644 4/20 0.44
GABRA1 P14867 3/20 0.44
GABRA3 P34903 3/20 0.44
GABRA2 P47869 3/20 0.44
ATM Q13315 1/20 0.43
MAOA P21397 1/20 0.43
DYRK1A Q13627 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
HSD17B10 Q99714 1/20 0.42
POLB P06746 1/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2D6 P10635 2/20 0.42
CYP2C19 P33261 1/20 0.42
HPGD P15428 2/20 0.42

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
SCHEMBL29445183 1.00 BCHE (0.54) BCHEACHEELANEGABRG2GABRB3
SCHEMBL8550668 0.89 DYRK1A (0.47) BCHEACHEELANEGABRG2GABRB3
SCHEMBL8545879 0.88 GAA (0.47) ELANESMN1; SMN2HSD17B10ALDH1A1HPGD
SCHEMBL7840124 0.88 GABRA1 (0.41) BCHEACHEELANEGABRG2GABRB3
SCHEMBL29445130 0.87 BCHE (0.58) BCHEACHEMAOADYRK1ASMN1; SMN2
SCHEMBL8546738 0.87 BCHE (0.58) BCHEACHEMAOADYRK1ASMN1; SMN2
Dimethylamine SCHEMBL8546919 0.85 BCHE (0.51) BCHEACHEMAOADYRK1AHSD17B10
Dimethylamine SCHEMBL8547407 0.83 BCHE (0.48) BCHEACHEMAOADYRK1AHSD17B10
SCHEMBL8547401 0.81 BCHE (0.46) BCHEACHEMAOADYRK1AHSD17B10
SCHEMBL24277273 0.81 ACHE (0.60) BCHEACHEMAOADYRK1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067639-A1 SMALL MOLECULES THAT TARGET THE RNA THAT CAUSES ALS University of Florida Research Foundation, Incorporation (US) 2024-02-29 US disclosed
US-20240067639-A1 SMALL MOLECULES THAT TARGET THE RNA THAT CAUSES ALS University of Florida Research Foundation, Incorporation (US) 2024-02-29 US disclosed
WO-2022055922-A1 SMALL MOLECULES THAT TARGET THE RNA THAT CAUSES ALS EXPANSION THERAPEUTICS, INC. (US) 2022-03-17 WO disclosed
US-5498611-A ANTITUMOR AGENTS ADIR ET COMPAGNIE (FR) 1996-03-12 US disclosed
US-5407940-A Antitumor agents ADIR ET COMPAGNIE (FR) 1995-04-18 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-20240067639-A1 SMALL MOLECULES THAT TARGET THE RNA THAT CAUSES ALS FUS, SNRPE, RRBP1 BCHE 3340/4885ACHE 3631/4885ELANE 1730/4885

“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.