SCHEMBL5149259

SCHEMBL5149259

Cn1nc(-c2nc(NC3CCN(Cc4ccccc4)CC3)c(N)nc2-c2ccccc2)ccc1=O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.49
LMNA P02545 2/20 0.48
MAPT P10636 2/20 0.48
NTSR1 P30989 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
GBA1 P04062 1/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HRH3 Q9Y5N1 1/20 0.43
NSD2 O96028 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
BCHE P06276 1/20 0.41
MALT1 Q9UDY8 1/20 0.41
KCNH2 Q12809 1/20 0.41
MCHR1 Q99705 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
SCHEMBL5149276 0.95 ACHE (0.43) ACHELMNAMAPTNTSR1HTT
SCHEMBL5152286 0.89 ACHE (0.47) ACHELMNAMAPTNTSR1HTT
SCHEMBL5151087 0.84 MALT1 (0.43) ACHELMNAMAPTNTSR1HTT
SCHEMBL5149179 0.82 SMN1; SMN2 (0.42) SMN1; SMN2HRH3GAAKCNH2
SCHEMBL5149284 0.79 ADORA3 (0.43) LMNAMAPTHTT
SCHEMBL5147908 0.77 GSK3B (0.41) SMN1; SMN2HRH3
SCHEMBL5152582 0.76 BRD4 (0.39) HRH3
SCHEMBL5149196 0.76 KAT2B (0.47) ACHEMAPTKMT2AHRH3GAA
SCHEMBL27659533 0.76 BRD4 (0.40) MAPTHTTHRH3KDM4E
SCHEMBL5152508 0.75 TLR9 (0.48) ACHELMNAHTTKMT2APOLB

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 ACHE 33/4885LMNA 2809/4885MAPT 1048/4885

“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.