SCHEMBL30125367

SCHEMBL30125367

CN(C)CCCNc1nc(Cl)nc2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.70
ALDH1A1 P00352 1/20 0.68
MAPK1 P28482 1/20 0.68
RAD52 P43351 4/20 0.64
TOP2A P11388 2/20 0.64
KMT2A Q03164 2/20 0.63
SLC2A1 P11166 2/20 0.63
NPC1 O15118 1/20 0.63
APOBEC3A P31941 1/20 0.63
RAB9A P51151 1/20 0.63
APOBEC3G Q9HC16 1/20 0.63
APP P05067 2/20 0.62
FLT3 P36888 8/20 0.60
RXFP1 Q9HBX9 1/20 0.59
PDE5A O76074 1/20 0.57
TLR9 Q9NR96 1/20 0.55

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
SCHEMBL8906802 1.00 POLB (0.70) POLBALDH1A1MAPK1RAD52TOP2A
SCHEMBL30621755 0.92 TLR9 (0.65) POLBALDH1A1MAPK1RAD52TOP2A
SCHEMBL8890410 0.92 TLR9 (0.65) POLBALDH1A1MAPK1RAD52TOP2A
SCHEMBL8906085 0.86 SLC2A1 (0.71) POLBALDH1A1MAPK1TOP2ASLC2A1
Hydrochloric Acid SCHEMBL8891454 0.85 POLB (0.72) POLBALDH1A1MAPK1TOP2ASLC2A1
SCHEMBL15502283 0.84 ACP1 (0.68) POLBKMT2ASLC2A1APPPDE5A
SCHEMBL7330423 0.84 KMT2A (0.67) POLBMAPK1RAD52KMT2AAPP
SCHEMBL14596040 0.82 ALDH1A1 (0.67) POLBALDH1A1MAPK1RAD52TOP2A
SCHEMBL11665848 0.82 APP (0.63) SLC2A1APPPDE5A
SCHEMBL30125146 0.81 APP (0.67) POLBKMT2AAPPPDE5A

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 POLB 1623/4885ALDH1A1 1908/4885MAPK1 3295/4885

“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.