SCHEMBL5408540

SCHEMBL5408540

CNc1nccn2ccnc12

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.46
FLT3 P36888 2/20 0.41
IKBKB O14920 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
ADORA3 P0DMS8 2/20 0.37
HTR6 P50406 2/20 0.34
YTHDC1 Q96MU7 1/20 0.33
SRC P12931 1/20 0.33
MAP4K4 O95819 1/20 0.32
AURKA O14965 2/20 0.32
BACE1 P56817 1/20 0.31
BACE2 Q9Y5Z0 1/20 0.31
GRIA1 P42261 1/20 0.31

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
SCHEMBL20265413 0.77 NUDT1 (0.52) NUDT1L3MBTL1AURKABACE1
SCHEMBL20319061 0.77 NUDT1 (0.42) NUDT1L3MBTL1SRCAURKA
SCHEMBL21471550 0.75 IKBKB (0.39) NUDT1FLT3IKBKBL3MBTL1HTR6
SCHEMBL2273731 0.75 HTR2C (0.47) NUDT1FLT3IKBKBL3MBTL1AURKA
SCHEMBL13572994 0.74 TTK (0.41) NUDT1FLT3
SCHEMBL3525899 0.73 NUDT1 (0.52) NUDT1L3MBTL1
SCHEMBL27897587 0.72 TTK (0.45) NUDT1ADORA3
SCHEMBL325223 0.72 NUDT1 (0.42) NUDT1IKBKBL3MBTL1MAP4K4
SCHEMBL18879056 0.71 MAP4K4 (0.51) FLT3IKBKBHTR6YTHDC1MAP4K4
SCHEMBL20278386 0.71 MAP4K4 (0.51) FLT3IKBKBHTR6SRCMAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024026256-A1 SUBSTITUTED IMIDAZOPYRAZINE COMPOUNDS AS LIGAND DIRECTED DEGRADERS OF IRAK3 CELGENE CORPORATION (US) 2024-02-01 WO disclosed
WO-2018119263-A1 HETEROCYCLIC COMPOUNDS DERIVATIVES AS PD-L1 INTERNALIZATION INDUCERS INCYTE CORPORATION (US) 2018-06-28 WO disclosed
US-7186832-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-03-06 US disclosed
US-7186832-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-03-06 US disclosed
US-7186832-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-03-06 US disclosed
US-7157460-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-01-02 US disclosed
US-7157460-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-01-02 US disclosed
US-20050009832-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN, INC. 2005-01-13 US disclosed
US-20040220189-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhbitors SUGEN, INC. 2004-11-04 US 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 (2 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-20050009832-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors MAP3K8, MAP3K2, MAP3K5 NUDT1 3312/4885FLT3 216/4885IKBKB 452/4885
US-20040220189-A1 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhbitors MAP3K8, MAP4K4, MAP3K2 NUDT1 1688/4885FLT3 215/4885IKBKB 337/4885

“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.