SCHEMBL30125342

SCHEMBL30125342

COc1ccc(CCNc2nc(NCCN(C)C)c3ccccc3n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.61
BCHE P06276 8/20 0.61
APP P05067 8/20 0.61
POLB P06746 1/20 0.57
RAD52 P43351 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57
MERTK Q12866 3/20 0.55
FLT3 P36888 1/20 0.55
TRIM58 Q8NG06 1/20 0.55
SLC2A1 P11166 1/20 0.53
ACP1 P24666 1/20 0.52
TLR9 Q9NR96 1/20 0.51

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
SCHEMBL23723424 1.00 ACHE (0.61) ACHEBCHEAPPPOLBRAD52
SCHEMBL23723422 0.94 RAD52 (0.66) ACHEBCHEAPPPOLBRAD52
SCHEMBL30125320 0.94 RAD52 (0.66) ACHEBCHEAPPPOLBRAD52
SCHEMBL30125352 0.88 ACHE (0.68) ACHEBCHEAPPPOLBRAD52
SCHEMBL23723423 0.88 ACHE (0.68) ACHEBCHEAPPPOLBRAD52
SCHEMBL23747941 0.87 ACHE (0.63) ACHEBCHEAPPPOLBRAD52
SCHEMBL30125168 0.87 ACHE (0.63) ACHEBCHEAPPPOLBRAD52
SCHEMBL23723440 0.87 ACHE (0.63) ACHEBCHEAPPPOLBRAD52
SCHEMBL1090319 0.85 TLR9 (0.67) ACHEBCHEAPPPOLBRAD52
SCHEMBL23723462 0.84 MERTK (0.77) POLBRAD52RXFP1MERTKFLT3

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
US-20230339866-A1 Quinazoline compounds and the use thereof in the treatment of cancer TroBio Therapeutics Pty Ltd (AU) 2023-10-26 US disclosed
EP-4100395-A1 QUINAZOLINE COMPOUNDS AND THE USE THEREOF IN THE TREATMENT OF CANCER Trobio Therapeutics Pty Ltd (AU) 2022-12-14 EP 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-20230339866-A1 Quinazoline compounds and the use thereof in the treatment of cancer NQO2, TP53, ABL1 ACHE 1215/4885BCHE 1774/4885APP 4864/4885

“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.