SCHEMBL23748372

SCHEMBL23748372

c1ccc2c(NCCc3c[nH]cn3)nc(-c3cc[nH]c3)nc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 7/20 0.53
GBA1 P04062 4/20 0.51
MAPK1 P28482 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ACP1 P24666 1/20 0.46
SLC6A3 Q01959 1/20 0.46
METAP1 P53582 2/20 0.46
JAK2 O60674 1/20 0.46
PPP1CA P62136 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CYP1A2 P05177 2/20 0.45
SIRT5 Q9NXA8 1/20 0.45
USP2 O75604 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL23748378 0.84 PDE5A (0.50) PDE5AGBA1MAPK1KDM4EACP1
SCHEMBL23748379 0.83 METAP1 (0.47) PDE5AGBA1MAPK1KDM4EACP1
SCHEMBL1083938 0.81 KMT2A (0.58) PDE5AGBA1MAPK1METAP1JAK2
SCHEMBL23748375 0.81 GBA1 (0.65) PDE5AGBA1MAPK1KDM4EMETAP1
SCHEMBL23747960 0.81 MAPK1 (0.71) PDE5AGBA1MAPK1KDM4EACP1
SCHEMBL26599007 0.80 APP (0.64) PDE5AGBA1MAPK1KDM4EMETAP1
SCHEMBL23748374 0.79 PDE5A (0.67) PDE5AGBA1MAPK1ACP1KMT2A
SCHEMBL23748991 0.78 TLR9 (0.72) PDE5AMAPK1KDM4EACP1SLC6A3
SCHEMBL26639503 0.76 MAPK1 (0.74) PDE5AGBA1MAPK1ACP1KMT2A
SCHEMBL26598931 0.76 PDE5A (0.53) PDE5AGBA1MAPK1KDM4EMETAP1

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
US-20230339866-A1 Quinazoline compounds and the use thereof in the treatment of cancer TroBio Therapeutics Pty Ltd (AU) 2023-10-26 US disclosed
US-20230339866-A1 Quinazoline compounds and the use thereof in the treatment of cancer TroBio Therapeutics Pty Ltd (AU) 2023-10-26 US disclosed
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 PDE5A 784/4885GBA1 1282/4885MAPK1 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.