SCHEMBL5149189

SCHEMBL5149189

CC(C)n1nc(-c2nc(OCc3ccccn3)c(N)nc2-c2ccccc2)ccc1=O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.42
AURKB Q96GD4 2/20 0.42
INCENP Q9NQS7 2/20 0.42
GRM5 P41594 5/20 0.40
MGMT P16455 1/20 0.37
GABRA1 P14867 10/20 0.37
GABRG2 P18507 10/20 0.37
GABRB3 P28472 10/20 0.37
GABRA3 P34903 10/20 0.37
GABRA2 P47869 10/20 0.37
GABRA5 P31644 9/20 0.37
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34

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
SCHEMBL5149200 0.88 SRC (0.43) MGMTADORA2A
SCHEMBL6133822 0.84 GRM5 (0.41) SYKAURKBINCENPGRM5MGMT
SCHEMBL5149212 0.83 SRC (0.40)
SCHEMBL5152824 0.83 MPO (0.38)
SCHEMBL5149185 0.83 GABRA1 (0.38) GABRA1GABRG2GABRB3GABRA3GABRA2
SCHEMBL5152714 0.83 SRC (0.38) ADORA2AADORA2B
SCHEMBL5147947 0.83 HRH3 (0.34) ADORA2AADORA2B
SCHEMBL5150959 0.83 FGFR1 (0.39) ADORA2A
SCHEMBL5149059 0.83 FGFR2 (0.35) ADORA2A
SCHEMBL5148946 0.83 SMN1; SMN2 (0.37) GABRA1GABRG2GABRB3GABRA3ADORA2A

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 disclosed
EP-1737841-A1 PYRAZINE DERIVATIVES AND PHARMACEUTICAL USE THEREOF AS ADENOSINE ANTAGONISTS Astellas Pharma Inc. (JP) 2007-01-03 EP disclosed
WO-2005095384-A1 PYRAZINE DERIVATIVES AND PHARMACEUTICAL USE THEREOF AS ADENOSINE ANTAGONISTS ASTELLAS PHARMA INC. (JP) 2005-10-13 WO 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 SYK 1977/4885AURKB 3952/4885INCENP 4497/4885

“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.