SCHEMBL3050783

SCHEMBL3050783

O=[N+]([O-])c1ccc(Cl)c(-c2ccc(C=NNc3nc4nonc4nc3NC3CCCCC3)o2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.50
MEN1 O00255 10/20 0.49
KMT2A Q03164 10/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
MAPT P10636 10/20 0.44
KDM4E B2RXH2 4/20 0.44
RAB9A P51151 3/20 0.44
ALDH1A1 P00352 5/20 0.41
CRHBP P24387 2/20 0.41
CRHR2 Q13324 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
BLM P54132 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
NPC1 O15118 2/20 0.40
GAA P10253 2/20 0.40
PKM P14618 1/20 0.40
DUSP3 P51452 1/20 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
SCHEMBL3050781 1.00 POLB (0.50) POLBMEN1KMT2AL3MBTL1MAPT
SCHEMBL6414523 0.86 RIPK1 (0.43) POLBMEN1KMT2AL3MBTL1MAPT
SCHEMBL6414510 0.86 RIPK1 (0.43) POLBMEN1KMT2AL3MBTL1MAPT
SCHEMBL3050786 0.83 MEN1 (0.51) POLBMEN1KMT2AL3MBTL1MAPT
SCHEMBL12417180 0.72 MEN1 (0.64) POLBMEN1KMT2AL3MBTL1MAPT
SCHEMBL3058290 0.72 MEN1 (0.54) POLBMEN1KMT2AL3MBTL1MAPT
SCHEMBL3058288 0.72 MEN1 (0.54) POLBMEN1KMT2AL3MBTL1MAPT
SCHEMBL6414075 0.70 MAPT (0.53) POLBMEN1KMT2AL3MBTL1MAPT
SCHEMBL6414077 0.70 MAPT (0.53) POLBMEN1KMT2AL3MBTL1MAPT
SCHEMBL3055376 0.69 MAPT (0.43) POLBMEN1KMT2AL3MBTL1MAPT

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222356-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2010-09-02 US claimed
US-20090131445-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2009-05-21 US claimed
EP-1799689-A1 FURAZANO `3, 4-B ! PYRAZYNES AND THEIR USE AS ANTI-TUMOR AGENTS Compass Pharmaceuticals LLC (US) 2007-06-27 EP claimed
WO-2006044402-A1 FURAZANO `3, 4-B ! PYRAZYNES AND THEIR USE AS ANTI-TUMOR AGENTS COMPASS PHARMACEUTICALS LLC (US) 2006-04-27 WO claimed
US-20100222356-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2010-09-02 US disclosed
US-20090131445-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2009-05-21 US disclosed
EP-1799689-A1 FURAZANO `3, 4-B ! PYRAZYNES AND THEIR USE AS ANTI-TUMOR AGENTS Compass Pharmaceuticals LLC (US) 2007-06-27 EP disclosed
WO-2006044402-A1 FURAZANO `3, 4-B ! PYRAZYNES AND THEIR USE AS ANTI-TUMOR AGENTS COMPASS PHARMACEUTICALS LLC (US) 2006-04-27 WO 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 (2 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-20100222356-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents CDC73, VHL, RB1 POLB 1513/4885MEN1 35/4885KMT2A 3960/4885
US-20090131445-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents CDC73, RB1, CA5A POLB 1467/4885MEN1 37/4885KMT2A 4211/4885

“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.