SCHEMBL5149209

SCHEMBL5149209

COc1ccc(CNc2nc(-c3ccc(=O)n(C(C)C)n3)c(-c3ccccc3)nc2C(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
POLB P06746 1/20 0.45
HIF1A Q16665 1/20 0.43
TP53 P04637 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
KLKB1 P03952 5/20 0.42
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 4/20 0.42
F2 P00734 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
KLK1 P06870 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPK1 P28482 2/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 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
SCHEMBL5148007 1.00 MAPT (0.45) MAPTPOLBHIF1ATP53RXFP1
SCHEMBL5147948 0.89 HIF1A (0.44) MAPTPOLBHIF1ATP53RXFP1
SCHEMBL5149098 0.87 HIF1A (0.44) MAPTPOLBHIF1ATP53RXFP1
SCHEMBL5148912 0.86 ALDH1A1 (0.46) MAPTPOLBHIF1ATP53RXFP1
SCHEMBL5149076 0.86 ALDH1A1 (0.46) MAPTPOLBHIF1ATP53RXFP1
SCHEMBL5150680 0.82 GAA (0.45) MAPTPOLBHIF1AKLKB1KDM4E
SCHEMBL5149215 0.82 GAA (0.45) MAPTPOLBHIF1AKLKB1KDM4E
SCHEMBL5149144 0.80 LDHA (0.39) MAPTHIF1ATP53RXFP1KDM4E
SCHEMBL5147925 0.79 HDAC1 (0.39) POLBKDM4EALDH1A1L3MBTL1HTT
SCHEMBL5149015 0.77 TP53 (0.39) MAPTPOLBTP53KDM4EALDH1A1

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 MAPT 1048/4885POLB 2847/4885HIF1A 416/4885

“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.