SCHEMBL23748378

SCHEMBL23748378

c1ccc2c(NCCc3c[nH]cn3)nc(-c3ccsc3)nc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 7/20 0.50
MAPK1 P28482 2/20 0.49
KDM4E B2RXH2 1/20 0.49
GBA1 P04062 6/20 0.48
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
ACP1 P24666 1/20 0.44
SLC6A3 Q01959 1/20 0.43
METAP1 P53582 2/20 0.43
JAK2 O60674 1/20 0.43
PPP1CA P62136 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL23748372 0.84 PDE5A (0.53) PDE5AMAPK1KDM4EGBA1KMT2A
SCHEMBL23748375 0.83 GBA1 (0.65) PDE5AMAPK1KDM4EGBA1KMT2A
SCHEMBL23748379 0.79 METAP1 (0.47) PDE5AMAPK1KDM4EGBA1KMT2A
SCHEMBL1083938 0.79 KMT2A (0.58) PDE5AMAPK1GBA1KMT2AMEN1
SCHEMBL23747958 0.79 MAPK1 (0.71) PDE5AMAPK1KDM4EGBA1KMT2A
SCHEMBL26599007 0.78 APP (0.64) PDE5AMAPK1KDM4EGBA1KMT2A
SCHEMBL30125496 0.76 TLR9 (0.72) PDE5AMAPK1KDM4EGBA1KMT2A
SCHEMBL17799977 0.76 GBA1 (0.54) PDE5AMAPK1KDM4EGBA1KMT2A
SCHEMBL23723436 0.76 TLR9 (0.72) PDE5AMAPK1KDM4EGBA1KMT2A
SCHEMBL23723245 0.75 PDE5A (0.53) PDE5AMAPK1KDM4EGBA1KMT2A

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 784/4885MAPK1 3295/4885KDM4E 2051/4885

“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.