SCHEMBL23747958

SCHEMBL23747958

OCCNc1nc(-c2ccsc2)nc2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.71
GBA1 P04062 2/20 0.64
ALDH1A1 P00352 2/20 0.62
LMNA P02545 1/20 0.62
HPGD P15428 1/20 0.62
PDE5A O76074 3/20 0.60
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
SIRT5 Q9NXA8 1/20 0.53
LATS1 O95835 1/20 0.53
LATS2 Q9NRM7 1/20 0.53
ACP1 P24666 2/20 0.52
KDM4E B2RXH2 2/20 0.52
POLB P06746 2/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TAAR1 Q96RJ0 1/20 0.51
RECQL P46063 1/20 0.49
TLR9 Q9NR96 1/20 0.49

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
SCHEMBL23748376 0.84 MAPK1 (0.74) MAPK1GBA1ALDH1A1PDE5AKMT2A
SCHEMBL17799977 0.84 GBA1 (0.54) MAPK1GBA1PDE5AMEN1KMT2A
SCHEMBL23723436 0.84 TLR9 (0.72) MAPK1GBA1ALDH1A1LMNAHPGD
SCHEMBL30125496 0.84 TLR9 (0.72) MAPK1GBA1ALDH1A1LMNAHPGD
SCHEMBL16404321 0.83 MAPK1 (0.82) MAPK1GBA1ALDH1A1LMNAHPGD
SCHEMBL23723245 0.83 PDE5A (0.53) MAPK1GBA1ALDH1A1PDE5AMEN1
SCHEMBL3459468 0.83 MAPK1 (0.82) MAPK1GBA1ALDH1A1LMNAHPGD
SCHEMBL17800078 0.81 ACP1 (0.59) GBA1PDE5AMEN1KMT2AACP1
SCHEMBL30125328 0.80 TLR9 (0.63) MAPK1GBA1ALDH1A1LMNAMEN1
SCHEMBL23723445 0.80 TLR9 (0.63) MAPK1GBA1ALDH1A1LMNAMEN1

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 MAPK1 3295/4885GBA1 1282/4885ALDH1A1 1908/4885

“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.