SCHEMBL5149185

SCHEMBL5149185

CC(C)n1nc(-c2nc(OCc3ccco3)c(N)nc2-c2ccccc2)ccc1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
TSHR P16473 3/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37
POLB P06746 2/20 0.37
USP2 O75604 1/20 0.37
RECQL P46063 1/20 0.37
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 2/20 0.33
ADORA1 P30542 1/20 0.33
SRC P12931 4/20 0.33
ABL1 P00519 3/20 0.33
ALDH1A1 P00352 3/20 0.32

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
SCHEMBL5150924 0.88 ADORA2A (0.41) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL5149200 0.87 SRC (0.43) HSD17B10ADORA2AADORA1SRCABL1
SCHEMBL5149189 0.83 SYK (0.42) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL5149212 0.82 SRC (0.40) SRCABL1ALDH1A1HCKFGFR1
SCHEMBL5152824 0.82 MPO (0.38) HSD17B10POLBSRCABL1ALDH1A1
SCHEMBL5147952 0.82 KDM4E (0.42) TSHRKDM4EHSD17B10POLBUSP2
SCHEMBL5150959 0.81 FGFR1 (0.39) POLBADORA2AADORA1SRCABL1
SCHEMBL5149059 0.81 FGFR2 (0.35) ADORA2AADORA1SRCABL1PIK3CA
SCHEMBL5148946 0.81 SMN1; SMN2 (0.37) GABRA1GABRG2GABRB3GABRA3ADORA2A
SCHEMBL5148967 0.81 HRH3 (0.36) 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 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 GABRA1 1014/4885GABRG2 1976/4885GABRB3 1762/4885

“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.