SCHEMBL22402771

SCHEMBL22402771

CNn1cnc2c(N(C)C)ncnc21

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.58
CYP2D6 P10635 1/20 0.58
MAPK1 P28482 1/20 0.58

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
SCHEMBL22399527 0.85 CYP1A2 (0.57) CYP1A2CYP2D6MAPK1
SCHEMBL9604572 0.77 CYP1A2 (0.69) CYP1A2CYP2D6MAPK1
Hydrochloric Acid SCHEMBL8169253 0.75 CYP1A2 (0.50) CYP1A2CYP2D6MAPK1
SCHEMBL8970970 0.75 YTHDC1 (0.66)
SCHEMBL9120 0.75 ADORA2A (0.59)
SCHEMBL9705702 0.75 CYP1A2 (0.62) CYP1A2CYP2D6MAPK1
SCHEMBL21539317 0.73 CYP1A2 (0.51) CYP1A2CYP2D6MAPK1
SCHEMBL754049 0.72 ADORA2A (0.60) CYP1A2CYP2D6MAPK1
SCHEMBL12410753 0.72 PI4KA (0.60) CYP1A2CYP2D6MAPK1
SCHEMBL12498653 0.72 CYP1A2 (0.78) CYP1A2CYP2D6MAPK1

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
WO-2023056478-A1 iRNA COMPOSITIONS AND METHODS FOR TARGETING ANGPTL7 ALNYLAM PHARMACEUTICALS, INC. (US) 2023-04-06 WO disclosed
WO-2023288045-A2 SIMPLE CHEMICAL APPROACHES TO INTRODUCE 2,6-DIAMINOPURINE AND 2-AMINOADENINE CONJUGATES INTO OLIGONUCLEOTIDES ALNYLAM PHARMACEUTICALS, INC. (US) 2023-01-19 WO disclosed
US-20200283468-A1 COMPOSITIONS AND METHODS OF MODULATING THE IMMUNE RESPONSE BY ACTIVATING ALPHA PROTEIN KINASE 1 LUMINEX INTERNATIONAL (CN) 2020-09-10 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-20200283468-A1 COMPOSITIONS AND METHODS OF MODULATING THE IMMUNE RESPONSE BY ACTIVATING ALPHA PROTEIN KINASE 1 PHKA1, PHKA2, PRKCA CYP1A2 3361/4885CYP2D6 4415/4885MAPK1 142/4885

“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.