SCHEMBL5149121

SCHEMBL5149121

Cn1nc(-c2nc(NCCNc3ccccc3)c(N)nc2-c2ccccc2)ccc1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.40
BRD4 O60885 2/20 0.37
ADORA1 P30542 2/20 0.36
ADORA2B P29275 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
TLR8 Q9NR97 3/20 0.35
ACHE P22303 3/20 0.33
BACE1 P56817 3/20 0.33
ATR Q13535 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CSF1R P07333 1/20 0.33
FGFR1 P11362 1/20 0.33
FLT1 P17948 1/20 0.33
KDR P35968 1/20 0.33
CSNK1A1 P48729 1/20 0.33
CDK8 P49336 1/20 0.33
GSK3A P49840 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
SCHEMBL5147908 0.88 GSK3B (0.41) ADORA2ABRD4BACE1GSK3B
SCHEMBL5149018 0.88 TLR8 (0.46) ALDH1A1TLR8
SCHEMBL5151060 0.88 ADORA2A (0.39) ADORA2AALDH1A1MAPTHTTMEN1
SCHEMBL5152582 0.88 BRD4 (0.39) ADORA2ABRD4ADORA1ADORA2BTLR8
SCHEMBL5149284 0.86 ADORA3 (0.43) ADORA2ABRD4ADORA1ALDH1A1MAPT
SCHEMBL5149196 0.85 KAT2B (0.47) ALDH1A1MAPTACHEMEN1KMT2A
SCHEMBL5149223 0.84 HIF1A (0.47) ADORA2AADORA1ADORA2BPIK3CD
SCHEMBL5152508 0.83 TLR9 (0.48) ADORA2AADORA1ALDH1A1HTTACHE
SCHEMBL5149160 0.82 HIF1A (0.45) ADORA2AADORA1ADORA2BALDH1A1MAPT
SCHEMBL5148992 0.81 ADORA2A (0.42) ADORA2AALDH1A1MAPTHTTMEN1

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 3 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
CN-1938296-A Pyrazine derivatives and pharmaceutical use thereof as adenosine antagonists ASTELLAS PHARMA INC (JP) 2007-03-28 CN 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 ADORA2A 1/4885BRD4 2661/4885ADORA1 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.