SCHEMBL23748375

SCHEMBL23748375

c1csc(-c2nc(NCCc3c[nH]cn3)c3ccccc3n2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 9/20 0.65
KDM4E B2RXH2 7/20 0.61
KMT2A Q03164 7/20 0.61
MAPT P10636 6/20 0.61
MEN1 O00255 6/20 0.61
ALDH1A1 P00352 5/20 0.61
PDE5A O76074 4/20 0.60
LMNA P02545 4/20 0.60
HTT P42858 3/20 0.60
HPGD P15428 1/20 0.54
ABCG2 Q9UNQ0 2/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
KDM1A O60341 1/20 0.47
MAPK1 P28482 2/20 0.46
JAK2 O60674 1/20 0.45
METAP1 P53582 1/20 0.45
PPP1CA P62136 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 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 0.83 PDE5A (0.50) GBA1KDM4EKMT2AMEN1ALDH1A1
SCHEMBL23748372 0.81 PDE5A (0.53) GBA1KDM4EKMT2AALDH1A1PDE5A
SCHEMBL1083938 0.80 KMT2A (0.58) GBA1KMT2AMAPTMEN1ALDH1A1
SCHEMBL23748379 0.80 METAP1 (0.47) GBA1KDM4EKMT2AALDH1A1PDE5A
SCHEMBL26599007 0.79 APP (0.64) GBA1KDM4EKMT2APDE5ALMNA
SCHEMBL23747962 0.79 GBA1 (1.00) GBA1KDM4EKMT2AMAPTMEN1
SCHEMBL17800023 0.76 GBA1 (0.72) GBA1KDM4EKMT2AMAPTMEN1
SCHEMBL26598931 0.76 PDE5A (0.53) GBA1KDM4EKMT2APDE5ALMNA
SCHEMBL7287132 0.75 KMT2A (1.00) GBA1KDM4EKMT2AMAPTMEN1
SCHEMBL30125338 0.75 GBA1 (0.66) GBA1KDM4EKMT2AMAPTMEN1

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 GBA1 1282/4885KDM4E 2051/4885KMT2A 1354/4885

“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.