SCHEMBL22987572

SCHEMBL22987572

FC(F)(F)c1cncc(-c2nc3c4ccccc4nc(Cl)n3n2)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 6/20 0.47
ADORA1 P30542 2/20 0.45
RXFP1 Q9HBX9 2/20 0.43
MAPT P10636 4/20 0.42
THRB P10828 1/20 0.42
TP53 P04637 2/20 0.39
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL22980157 0.88 ADORA3 (0.51) ADORA3ADORA1RXFP1MAPTTP53
SCHEMBL29646327 0.88 ADORA3 (0.51) ADORA3ADORA1RXFP1MAPTTP53
SCHEMBL29646371 0.86 ADORA3 (0.50) ADORA3ADORA1RXFP1MAPTTHRB
SCHEMBL22987432 0.86 ADORA3 (0.50) ADORA3ADORA1RXFP1MAPTTHRB
SCHEMBL22987858 0.85 ADORA3 (0.48) ADORA3ADORA1RXFP1MAPTTHRB
SCHEMBL22979717 0.84 ADORA3 (0.64) ADORA3ADORA1MAPTTP53MEN1
SCHEMBL22987673 0.84 ADORA3 (0.50) ADORA3ADORA1RXFP1MAPTTHRB
SCHEMBL29646344 0.84 ADORA3 (0.64) ADORA3ADORA1MAPTTP53MEN1
SCHEMBL22979023 0.79 ADORA3 (0.69) ADORA3ADORA1MAPTTHRBTP53
SCHEMBL29646414 0.79 ADORA3 (0.69) ADORA3ADORA1MAPTTHRBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 ADORA3 34/4885ADORA1 21/4885RXFP1 154/4885

“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.