SCHEMBL22980792

SCHEMBL22980792

CCn1cc(-c2nc3c4cccc(OC)c4nc(N[C@@H]4CCCCNC4=O)n3n2)cn1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 16/20 0.39
ADORA1 P30542 1/20 0.39
KCNH2 Q12809 1/20 0.39
ADORA2B P29275 1/20 0.35
HSP90AB1 P08238 1/20 0.35
TNF P01375 1/20 0.34
LITAF Q99732 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL22988156 0.91 ADORA2A (0.39) ADORA2AADORA1ADORA2B
SCHEMBL31149998 0.90 PIM1 (0.35) ADORA2AADORA1ADORA2B
SCHEMBL22979137 0.90 PIM1 (0.35) ADORA2AADORA1ADORA2BHSP90AB1TNF
SCHEMBL22978999 0.90 PIM1 (0.35) ADORA2AADORA1ADORA2B
SCHEMBL22988433 0.90 PIM1 (0.35) ADORA2AADORA1ADORA2B
SCHEMBL29645678 0.90 PIM1 (0.35) ADORA2AADORA1ADORA2BHSP90AB1TNF
SCHEMBL29648877 0.90 PIM1 (0.35) ADORA2AADORA1ADORA2B
SCHEMBL22980020 0.89 ADORA2A (0.38) ADORA2AADORA1KCNH2
SCHEMBL22979685 0.88 PIM1 (0.34) ADORA2AADORA1KCNH2ADORA2BTP53
SCHEMBL22988377 0.88 ADORA2A (0.38) ADORA2AADORA1

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
CN-114466850-B [1,2,4] Triazolo [1,5-C ] quinazolin-5-amine 拜耳股份有限公司 2024-09-10 CN claimed
EP-4013508-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES Bayer Aktiengesellschaft (DE) 2022-06-22 EP claimed
WO-2021028382-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2021-02-18 WO 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 ADORA2A 103/4885ADORA1 21/4885KCNH2 1271/4885

“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.