SCHEMBL5149223

SCHEMBL5149223

Cn1nc(-c2nc(NCCc3ccccn3)c(N)nc2-c2ccccc2)ccc1=O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 4/20 0.47
ADORA2A P29274 4/20 0.43
ADORA1 P30542 2/20 0.43
TLR9 Q9NR96 1/20 0.41
MAOB P27338 1/20 0.39
ADORA2B P29275 1/20 0.39
GBA1 P04062 1/20 0.39
MKNK1 Q9BUB5 1/20 0.38
AURKA O14965 1/20 0.37
PIK3CD O00329 1/20 0.36
PGK1 P00558 1/20 0.36
CYP1A2 P05177 1/20 0.36
F2 P00734 1/20 0.36
PRSS1 P07477 1/20 0.36
GRM5 P41594 1/20 0.36
APP P05067 2/20 0.35

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
SCHEMBL5149160 0.90 HIF1A (0.45) HIF1AADORA2AADORA1ADORA2BAURKA
SCHEMBL5149090 0.88 HIF1A (0.45) HIF1AADORA2AADORA1TLR9MAOB
SCHEMBL5147908 0.87 GSK3B (0.41) HIF1AADORA2ACYP1A2APP
SCHEMBL5152582 0.84 BRD4 (0.39) ADORA2AADORA1ADORA2B
SCHEMBL5149121 0.84 ADORA2A (0.40) ADORA2AADORA1ADORA2BPIK3CD
SCHEMBL6483231 0.84 HIF1A (0.40) HIF1AADORA2AADORA1MAOBADORA2B
SCHEMBL5149018 0.83 TLR8 (0.46) CYP1A2
SCHEMBL5151060 0.82 ADORA2A (0.39) ADORA2AF2
SCHEMBL5149284 0.81 ADORA3 (0.43) HIF1AADORA2AADORA1
SCHEMBL5149196 0.80 KAT2B (0.47) TLR9

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-7265120-B2 Pyrazine derivatives and pharmaceutical use thereof ASTELLAS PHARMA INC. (JP) 2007-09-04 US disclosed
US-20050222159-A1 Pyrazine derivatives and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-10-06 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 (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-20050222159-A1 Pyrazine derivatives and pharmaceutical use thereof ADORA2A, HTR5A, ADORA1 HIF1A 416/4885ADORA2A 1/4885ADORA1 3/4885

“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.