SCHEMBL5000688

SCHEMBL5000688

CC(=O)Nc1ccc(-c2cncc(Nc3ccccc3)n2)cc1

nearest known ligand 0.77

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRAF P15056 17/20 0.77
JAK2 O60674 1/20 0.58
JAK3 P52333 1/20 0.58
MAPT P10636 2/20 0.56
POLB P06746 1/20 0.56
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
KMT2A Q03164 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56

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
SCHEMBL5003165 0.88 BRAF (0.63) BRAFMAPTMEN1KMT2A
SCHEMBL1122285 0.87 BRAF (1.00) BRAF
SCHEMBL31060333 0.87 BRAF (1.00) BRAF
SCHEMBL14394067 0.82 LDHA (0.64) BRAFMAPTPOLBMEN1ALDH1A1
SCHEMBL13315247 0.81 BRAF (0.63) BRAFMAPTMEN1KMT2A
SCHEMBL4997513 0.81 BRAF (0.83) BRAF
SCHEMBL4992128 0.80 BRAF (0.60) BRAFMAPTMEN1ALDH1A1KMT2A
SCHEMBL4996944 0.80 BRAF (0.64) BRAFJAK2
SCHEMBL5000385 0.80 BRAF (0.62) BRAF
SCHEMBL1122550 0.80 BRAF (0.81) BRAF

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-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases AXXIMA PHARMACEUTICALS AG (DE) 2008-08-14 US claimed
US-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases AXXIMA PHARMACEUTICALS AG (DE) 2008-08-14 US disclosed
EP-1694670-A1 PYRAZINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES GPC Biotech AG (DE) 2006-08-30 EP disclosed
WO-2005058876-A1 PYRAZINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES GPC BIOTECH AG (DE) 2005-06-30 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 (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-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases PRNP, PSEN1, PPP5C BRAF 478/4885JAK2 969/4885JAK3 645/4885

“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.