SCHEMBL22988151

SCHEMBL22988151

FC(F)(F)c1cccc2c1nc(Cl)n1nc(-c3cnn(CC4CC4)c3)nc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.38
RIPK1 Q13546 1/20 0.36
ADORA2B P29275 4/20 0.34
ADORA3 P0DMS8 4/20 0.34
ADORA2A P29274 2/20 0.34
ADORA1 P30542 2/20 0.34
LRRK2 Q5S007 2/20 0.34
CLK2 P49760 1/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PI4KA P42356 1/20 0.34
PIK3CG P48736 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
CRHR1 P34998 1/20 0.34
PDK2 Q15119 1/20 0.33
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
CREBBP Q92793 1/20 0.33

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
SCHEMBL22988227 0.96 PDK2 (0.36) GRM2RIPK1ADORA2BADORA3ADORA2A
SCHEMBL22987611 0.88 ADORA3 (0.38) ADORA3ADORA2AADORA1PIK3CAPDK2
SCHEMBL22987761 0.85 PIK3CD (0.35) GRM2ADORA2BADORA3ADORA2AADORA1
SCHEMBL22978982 0.85 ADORA3 (0.38) ADORA3ADORA2AADORA1LRRK2CLK2
SCHEMBL29646424 0.85 ADORA3 (0.38) ADORA3ADORA2AADORA1LRRK2CLK2
SCHEMBL22988153 0.84 IRAK4 (0.36) LRRK2CLK2PIM1KCNH2
SCHEMBL22987771 0.82 GRM2 (0.36) GRM2ADORA2BADORA3ADORA2AADORA1
SCHEMBL22988248 0.81 HSP90AA1 (0.35) ADORA3ADORA2AADORA1NR1H2NR1H3
SCHEMBL22987630 0.81 PDK2 (0.36) ADORA3ADORA2AADORA1PDK2NR1H2
SCHEMBL22987682 0.80 ADORA2B (0.42) RIPK1ADORA2BADORA3ADORA2AADORA1

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 GRM2 2922/4885RIPK1 1913/4885ADORA2B 86/4885

“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.