SCHEMBL22979649

SCHEMBL22979649

COc1ccc(-c2nc3c4cccc(S(C)(=O)=O)c4nc(N[C@@H]4CNCCNC4=O)n3n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
XDH P47989 1/20 0.39
ADORA3 P0DMS8 14/20 0.38
MAPT P10636 3/20 0.37
THRB P10828 1/20 0.37
ADORA1 P30542 5/20 0.35
ADORA2A P29274 4/20 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
SCHEMBL22988489 0.92 KDM4E (0.40) KDM4EALDH1A1POLBXDHADORA3
SCHEMBL22988283 0.92 KDM4E (0.42) KDM4EALDH1A1POLBXDHADORA3
SCHEMBL29645506 0.92 KDM4E (0.42) KDM4EALDH1A1POLBXDHADORA3
SCHEMBL22979411 0.89 KDM4E (0.41) KDM4EALDH1A1POLBXDHADORA3
SCHEMBL22988499 0.89 KDM4E (0.44) KDM4EALDH1A1POLBXDHADORA3
SCHEMBL22987899 0.89 KDM4E (0.44) KDM4EALDH1A1POLBXDHADORA3
SCHEMBL29646081 0.89 KDM4E (0.44) KDM4EALDH1A1POLBXDHADORA3
SCHEMBL22988406 0.88 KDM4E (0.43) KDM4EALDH1A1POLBXDHADORA3
SCHEMBL22980837 0.88 KDM4E (0.43) KDM4EALDH1A1POLBXDHADORA3
SCHEMBL22988395 0.88 KDM4E (0.43) KDM4EALDH1A1POLBXDHADORA3

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 6 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
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
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 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 KDM4E 1364/4885ALDH1A1 597/4885POLB 4033/4885

“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.