SCHEMBL22979003

SCHEMBL22979003

CCn1cc(-c2nc3c4cccc(Cl)c4nc(N[C@@H]4CNCCNC4=O)n3n2)cn1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 8/20 0.34
HSP90AB1 P08238 1/20 0.33
MAPT P10636 2/20 0.32
THRB P10828 1/20 0.32
ADORA3 P0DMS8 3/20 0.32
ADORA2A P29274 3/20 0.32
ADORA1 P30542 3/20 0.32
PIM3 Q86V86 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
ADORA2B P29275 1/20 0.32
SYK P43405 2/20 0.30
FLT3 P36888 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
SCHEMBL29645885 1.00 PIM1 (0.34) PIM1HSP90AB1MAPTTHRBADORA3
SCHEMBL22988486 0.91 PIM1 (0.34) PIM1PIM3PIM2ADORA2BSYK
SCHEMBL29646112 0.91 PIM1 (0.34) PIM1PIM3PIM2SYKFLT3
SCHEMBL22979188 0.91 PIM1 (0.34) PIM1PIM3PIM2SYKFLT3
SCHEMBL22987891 0.91 RPLP1 (0.34) ADORA3ADORA2AADORA1ADORA2B
SCHEMBL22988129 0.90 PIM1 (0.33) PIM1ADORA3ADORA2AADORA1PIM3
SCHEMBL29646167 0.90 PIM1 (0.33) PIM1ADORA3ADORA2AADORA1PIM3
SCHEMBL22979137 0.89 PIM1 (0.35) PIM1HSP90AB1MAPTTHRBADORA3
SCHEMBL29645678 0.89 PIM1 (0.35) PIM1HSP90AB1MAPTTHRBADORA3
SCHEMBL22988234 0.89 AURKB (0.33) PIM1HSP90AB1MAPTTHRBSYK

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
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 PIM1 3095/4885HSP90AB1 2893/4885MAPT 4047/4885

“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.