SCHEMBL22988286

SCHEMBL22988286

CC(C)n1cc(-c2nc3c4cccc(Br)c4nc(N[C@@H]4CNCCNC4=O)n3n2)cn1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 2/20 0.33
AURKA O14965 1/20 0.33
PDPK1 O15530 1/20 0.33
RPS6KB1 P23443 1/20 0.33
BRD4 O60885 2/20 0.32
CREBBP Q92793 2/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
JAK3 P52333 1/20 0.32
FLT3 P36888 2/20 0.32
SYK P43405 2/20 0.32
WNT1 P04628 1/20 0.31
GSK3B P49841 1/20 0.31
DYRK1A Q13627 1/20 0.31
PIM1 P11309 1/20 0.30

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
SCHEMBL22988125 1.00 AURKB (0.33) AURKBAURKAPDPK1RPS6KB1BRD4
SCHEMBL22979320 0.93 SYK (0.30) SYK
SCHEMBL22987861 0.91 ADORA3 (0.34) PIM1
SCHEMBL22988299 0.91 ADORA3 (0.34) PIM1
SCHEMBL22979336 0.91 JAK2 (0.34) AURKBAURKAPDPK1RPS6KB1BRD4
SCHEMBL29645907 0.91 JAK2 (0.34) AURKBAURKAPDPK1RPS6KB1BRD4
SCHEMBL22988234 0.91 AURKB (0.33) AURKBAURKAPDPK1RPS6KB1BRD4
SCHEMBL22979325 0.90 JAK2 (0.34) AURKBAURKAPDPK1RPS6KB1BRD4
SCHEMBL22988441 0.89 PDE3B (0.33) AURKBAURKAPDPK1RPS6KB1BRD4
SCHEMBL22979392 0.89 PDE3B (0.33) AURKBAURKAPDPK1RPS6KB1BRD4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4013508-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES Bayer Aktiengesellschaft (DE) 2022-06-22 EP claimed
CN-114466850-A [1,2,4] triazolo [1,5-C ] quinazolin-5-amines 拜耳股份有限公司 2022-05-10 CN claimed
US-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed
WO-2021028382-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2021-02-18 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-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES AHR, HRH4, HRH1 AURKB 2087/4885AURKA 1334/4885PDPK1 1415/4885

“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.