SCHEMBL23022181

SCHEMBL23022181

CN(C)C(=O)c1cnn(-c2nc(Br)cnc2N)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.43
PIK3CD O00329 1/20 0.38
PIK3R1 P27986 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
ATR Q13535 13/20 0.36
LDHA P00338 1/20 0.36
LDHB P07195 1/20 0.36
CHEK2 O96017 1/20 0.36
KMT2A Q03164 1/20 0.35
USP7 Q93009 1/20 0.35
PDE10A Q9Y233 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
SCHEMBL23012663 0.83 ALKBH2 (0.46) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL29507151 0.83 ALKBH2 (0.46) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL31448239 0.83 PIK3CD (0.47) ADORA2APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL31448269 0.79 ADORA2A (0.46) ADORA2APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL23022201 0.79 ADORA2A (0.46) ADORA2APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL23022254 0.78 ADORA2A (0.40) ADORA2APIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL31448116 0.74 CHEK1 (0.56) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL31448254 0.74 PIK3CD (0.50) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL31448229 0.74 HDAC6 (0.41) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL23012226 0.74 ADORA2A (0.48) ADORA2APIK3CDPIK3R1PIK3CAPIK3CB

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-114341127-B Aminopyrazine compounds as HPK1 inhibitors and uses thereof 百济神州有限公司 2024-12-17 CN disclosed
CN-116082307-A HPK1 inhibitor and application thereof in medicine 贝达药业股份有限公司 2023-05-09 CN disclosed
US-20220289712-A1 AMINOPYRAZINE COMPOUNDS AS HPK1 INHIBITOR AND THE USE THEREOF BEONE MEDICINES I GMBH (CH) 2022-09-15 US disclosed
CN-114341127-A Aminopyrazine compounds as HPK1 inhibitors and uses thereof 百济神州有限公司 2022-04-12 CN disclosed
WO-2021032148-A1 AMINOPYRAZINE COMPOUNDS AS HPK1 INHIBITOR AND THE USE THEREOF BEIGENE, LTD. (KY) 2021-02-25 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-20220289712-A1 AMINOPYRAZINE COMPOUNDS AS HPK1 INHIBITOR AND THE USE THEREOF MAPKAPK5, STK25, STK35 ADORA2A 3042/4885PIK3CD 1894/4885PIK3R1 1806/4885

“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.