SCHEMBL23747962

SCHEMBL23747962

OCCNc1nc(-c2cccs2)nc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 8/20 1.00
ALDH1A1 P00352 6/20 0.70
KDM4E B2RXH2 6/20 0.70
MAPT P10636 6/20 0.70
MEN1 O00255 6/20 0.70
KMT2A Q03164 6/20 0.70
LMNA P02545 4/20 0.70
PDE5A O76074 4/20 0.70
HTT P42858 2/20 0.70
MAPK1 P28482 1/20 0.65
HPGD P15428 2/20 0.63
TDP1 Q9NUW8 1/20 0.56
ABCG2 Q9UNQ0 1/20 0.55
KDM1A O60341 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54

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
SCHEMBL7610940 0.88 GBA1 (0.78) GBA1ALDH1A1KDM4EMAPTMEN1
SCHEMBL7612114 0.88 GBA1 (0.78) GBA1ALDH1A1KDM4EMAPTMEN1
SCHEMBL7605588 0.86 GBA1 (0.75) GBA1ALDH1A1KDM4EMAPTMEN1
SCHEMBL7610689 0.86 GBA1 (0.75) GBA1ALDH1A1KDM4EMAPTMEN1
SCHEMBL16404321 0.84 MAPK1 (0.82) GBA1ALDH1A1KDM4EMAPTMEN1
SCHEMBL17800023 0.84 GBA1 (0.72) GBA1ALDH1A1KDM4EMAPTMEN1
SCHEMBL7287132 0.83 KMT2A (1.00) GBA1ALDH1A1KDM4EMAPTMEN1
SCHEMBL17800064 0.81 GBA1 (0.69) GBA1ALDH1A1KDM4EMAPTMEN1
SCHEMBL30125338 0.80 GBA1 (0.66) GBA1ALDH1A1KDM4EMAPTMEN1
SCHEMBL23723476 0.80 GBA1 (0.66) GBA1ALDH1A1KDM4EMAPTMEN1

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 1282/4885ALDH1A1 1908/4885KDM4E 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.