SCHEMBL5148992

SCHEMBL5148992

Cn1nc(-c2nc(NCc3ccco3)c(N)nc2-c2ccccc2)ccc1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.42
HPGD P15428 3/20 0.42
PDE5A O76074 1/20 0.41
REN P00797 1/20 0.41
KMT2A Q03164 8/20 0.41
MEN1 O00255 6/20 0.41
ALDH1A1 P00352 4/20 0.41
NPSR1 Q6W5P4 3/20 0.41
KDM4E B2RXH2 2/20 0.41
PKM P14618 2/20 0.41
MAPK1 P28482 2/20 0.41
PKLR P30613 1/20 0.41
MAPT P10636 8/20 0.41
POLB P06746 2/20 0.41
LMNA P02545 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
HSD17B10 Q99714 3/20 0.40
TSHR P16473 2/20 0.40

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
SCHEMBL5147952 0.88 KDM4E (0.42) ADORA2AHPGDPDE5ARENKMT2A
SCHEMBL5149284 0.86 ADORA3 (0.43) ADORA2AHPGDALDH1A1PKMMAPT
SCHEMBL5149160 0.82 HIF1A (0.45) ADORA2APDE5AKMT2AMEN1ALDH1A1
SCHEMBL5149121 0.81 ADORA2A (0.40) ADORA2AKMT2AMEN1ALDH1A1MAPT
SCHEMBL5150924 0.81 ADORA2A (0.41) ADORA2AHPGDKMT2AMEN1ALDH1A1
SCHEMBL5147908 0.80 GSK3B (0.41) ADORA2APDE5APKMSMN1; SMN2
SCHEMBL5149018 0.80 TLR8 (0.46) HPGDALDH1A1KDM4EPOLBLMNA
SCHEMBL5148003 0.80 HIF1A (0.46) HPGDKMT2AMEN1ALDH1A1NPSR1
SCHEMBL5151060 0.79 ADORA2A (0.39) ADORA2AHPGDKMT2AMEN1ALDH1A1
SCHEMBL5152582 0.79 BRD4 (0.39) ADORA2A

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 1/4885HPGD 375/4885PDE5A 321/4885

“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.