SCHEMBL23723296

SCHEMBL23723296

O=C(O)NCCNc1nc(Cl)nc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.63
PDE5A O76074 1/20 0.58
CYP1A2 P05177 9/20 0.56
CYP3A4 P08684 7/20 0.56
CYP2D6 P10635 7/20 0.56
ALDH1A1 P00352 6/20 0.56
CYP2C19 P33261 2/20 0.56
CLK4 Q9HAZ1 4/20 0.54
HSD17B10 Q99714 2/20 0.54
CYP2C9 P11712 1/20 0.54
TSHR P16473 5/20 0.48
KDM4E B2RXH2 2/20 0.48
ALOX15 P16050 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
RECQL P46063 1/20 0.48
HBB P68871 1/20 0.48
SIRT5 Q9NXA8 2/20 0.48

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
SCHEMBL23723248 0.92 APP (0.60) APPPDE5ACYP1A2CYP3A4CYP2D6
SCHEMBL10836929 0.89 CYP1A2 (0.70) APPPDE5ACYP1A2CYP3A4CYP2D6
SCHEMBL30621767 0.82 BRD4 (0.56) APPPDE5ACYP1A2CYP3A4CYP2D6
SCHEMBL8899455 0.82 BRD4 (0.56) APPPDE5ACYP1A2CYP3A4CYP2D6
SCHEMBL15140408 0.82 L3MBTL1 (0.49) APPALDH1A1HSD17B10KDM4ELMNA
SCHEMBL7337304 0.82 APP (0.70) APPPDE5AALDH1A1KDM4ELMNA
SCHEMBL7330423 0.79 KMT2A (0.67) APPPDE5AKDM4ELMNAMAPT
SCHEMBL30125146 0.79 APP (0.67) APPPDE5AKMT2AMEN1
SCHEMBL8270953 0.79 TOP2A (0.67) APPPDE5AALDH1A1TSHRKDM4E
SCHEMBL4904310 0.79 APP (0.70) APPPDE5AALDH1A1KDM4EACHE

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
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
WO-2021155426-A1 QUINAZOLINE COMPOUNDS AND THE USE THEREOF IN THE TREATMENT OF CANCER TroBio Therapeutics Pty Ltd (AU) 2021-08-12 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-20230339866-A1 Quinazoline compounds and the use thereof in the treatment of cancer NQO2, TP53, ABL1 APP 4864/4885PDE5A 784/4885CYP1A2 1020/4885

“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.