SCHEMBL3050864

SCHEMBL3050864

CCCCNc1nc2nonc2nc1Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
TP53 P04637 3/20 0.47
CCR2 P41597 1/20 0.47
CCR5 P51681 1/20 0.47
STK17A Q9UEE5 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
STK17B O94768 2/20 0.45
ALDH1A1 P00352 1/20 0.45
HTT P42858 1/20 0.45
POLB P06746 3/20 0.42
EPHA2 P29317 1/20 0.40
KDR P35968 1/20 0.40
KDM4E B2RXH2 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ABL1 P00519 1/20 0.39
SLC2A1 P11166 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL3052141 0.84 KDM4E (0.55) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL3041848 0.84 MAPT (0.46) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL3051396 0.84 TP53 (0.55) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL26035373 0.82 TP53 (0.49) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL3048542 0.81 MAPT (0.47) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL3059036 0.80 TP53 (0.53) MAPTSMN1; SMN2TP53CCR2CCR5
Ammonia Solution, Strong SCHEMBL4262504 0.80 KDM4E (0.39) MAPTTP53STK17AHTTPOLB
Ammonia Solution, Strong SCHEMBL4262270 0.79 MAPT (0.53) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL3055646 0.79 TP53 (0.58) MAPTSMN1; SMN2TP53CCR2CCR5
SCHEMBL3056838 0.78 MAPT (0.41) MAPTSMN1; SMN2TP53CCR2CCR5

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-20120178754-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2012-07-12 US claimed
US-20100222356-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2010-09-02 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-20120178754-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2012-07-12 US disclosed
US-20100222356-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2010-09-02 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 MAPT 3908/4885SMN1; SMN2 243/4885TP53 4/4885
US-20120178754-A1 Furazano '3, 4-B! Pyrazines and Their Use as Anti-Tumor Agents CDC73, VHL, RB1 MAPT 3908/4885SMN1; SMN2 243/4885TP53 4/4885

“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.