SCHEMBL5149040

SCHEMBL5149040

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.42
CHEK1 O14757 1/20 0.41
ABL1 P00519 1/20 0.41
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
FLT1 P17948 1/20 0.41
GRK5 P34947 1/20 0.41
KDR P35968 1/20 0.41
MAP2K2 P36507 1/20 0.41
CDK8 P49336 1/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
PRKX P51817 1/20 0.41
NEK2 P51955 1/20 0.41
LIMK1 P53667 1/20 0.41
MAP2K1 Q02750 1/20 0.41
PRKCQ Q04759 1/20 0.41
MAP4K2 Q12851 1/20 0.41
DYRK1A Q13627 1/20 0.41
IKBKE Q14164 1/20 0.41

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
SCHEMBL5147917 0.91 ADORA2A (0.48) BRD4CHEK1ABL1PDGFRBPDGFRA
SCHEMBL5152899 0.83 USP8 (0.40) CHEK1ABL1PDGFRBPDGFRAFLT1
SCHEMBL5147969 0.83 HTT (0.43) CHEK1ABL1PDGFRBPDGFRAFLT1
SCHEMBL5147984 0.80 BRD4 (0.43) BRD4FLT1KDRCDK8GSK3A
SCHEMBL5152370 0.79 GRM4 (0.38) BRD4ABL1FLT1KDRCDK8
SCHEMBL5147975 0.79 ALDH1A1 (0.48) MAPK14ALDH1A1KDM4EMAPTL3MBTL1
SCHEMBL5152848 0.76 ALDH1A1 (0.41) BRD4FLT1KDRCDK8GSK3A
SCHEMBL5149114 0.76 BRD4 (0.40) BRD4FLT1KDRCDK8GSK3A
SCHEMBL5147962 0.76 USP8 (0.46) CHEK1ABL1PDGFRBPDGFRAFLT1
SCHEMBL5147922 0.76 USP8 (0.46) CHEK1ABL1PDGFRBPDGFRAFLT1

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 BRD4 2661/4885CHEK1 4142/4885ABL1 2520/4885

“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.