SCHEMBL5149097

SCHEMBL5149097

CC(C)n1nc(-c2nc(C(N)=O)c(N)nc2-c2ccccc2)ccc1=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.41
MAP2K3 P46734 1/20 0.40
PLAU P00749 3/20 0.39
TP53 P04637 1/20 0.39
ADORA2A P29274 12/20 0.38
POLB P06746 1/20 0.37
AURKA O14965 1/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
PLK1 P53350 1/20 0.35
CCNA1 P78396 1/20 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
SCHEMBL5152629 1.00 RET (0.41) RETMAP2K3PLAUTP53ADORA2A
SCHEMBL5152639 0.92 PLAU (0.40) RETPLAUTP53ADORA2APOLB
SCHEMBL5149017 0.91 TP53 (0.43) RETPLAUTP53ADORA2APOLB
SCHEMBL5147937 0.91 TP53 (0.37) RETPLAUTP53ADORA2APOLB
SCHEMBL5152804 0.90 MAP2K3 (0.41) RETMAP2K3ADORA2A
SCHEMBL5152750 0.89 ADORA2A (0.45) RETADORA2A
SCHEMBL5149227 0.89 HPGDS (0.41) RETADORA2A
SCHEMBL5147958 0.86 ADORA2A (0.39) RETTP53ADORA2APOLB
SCHEMBL5149107 0.85 TP53 (0.37) RETMAP2K3TP53ADORA2APOLB
SCHEMBL5147991 0.85 TP53 (0.37) RETMAP2K3TP53ADORA2APOLB

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 4 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 claimed
US-20050222159-A1 Pyrazine derivatives and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-10-06 US claimed
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 RET 2434/4885MAP2K3 3138/4885PLAU 3133/4885

“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.