SCHEMBL22123554

SCHEMBL22123554

CNCCN(C)C(=O)CN

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRMT3 O60678 1/20 0.42
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
PRMT1 Q99873 1/20 0.42
PRMT8 Q9NR22 1/20 0.42
AOC3 Q16853 7/20 0.33
KDM4A O75164 1/20 0.33
KDM4C Q9H3R0 1/20 0.33

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
SCHEMBL24225246 0.80 PRMT3 (0.44) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL3318828 0.80 PRMT3 (0.44) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL12022327 0.80 PRMT3 (0.44) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL1831524 0.80 PRMT3 (0.44) PRMT3CARM1PRMT6PRMT1PRMT8
Hydrochloric Acid SCHEMBL8984856 0.79 AOC3 (0.38) AOC3
SCHEMBL17150768 0.78 PRMT3 (0.42) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL10013647 0.78 PRMT3 (0.42) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL23732847 0.78 PRMT3 (0.38) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL23732697 0.77 KDM4A (0.45) KDM4AKDM4C
SCHEMBL22752133 0.77 CYP2C9 (0.31)

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
EP-3898631-B1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS HOFFMANN LA ROCHE (CH) 2023-01-18 EP disclosed
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-12 US disclosed
EP-3898631-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. Hoffmann-La Roche AG (CH) 2021-10-27 EP disclosed
CN-113195497-A Novel imidazopyrazine derivatives 豪夫迈·罗氏有限公司 2021-07-30 CN disclosed
WO-2020126953-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 WO 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-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, MYD88, IL1R1 PRMT3 1704/4885CARM1 1910/4885PRMT6 2166/4885

“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.