SCHEMBL4995151

SCHEMBL4995151

Nc1cccc(-c2cncc(Nc3ccc(Cl)cc3)n2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.64
FYN P06241 1/20 0.55
BRAF P15056 7/20 0.52
KCNH2 Q12809 1/20 0.50
SCN5A Q14524 1/20 0.50
SCN9A Q15858 1/20 0.50
AGPAT2 O15120 1/20 0.50
CAMK2D Q13557 1/20 0.45
CDK1 P06493 1/20 0.45
EGFR P00533 2/20 0.45
FGFR2 P21802 2/20 0.45
GSK3A P49840 2/20 0.45
GSK3B P49841 2/20 0.45
INSR P06213 1/20 0.45
PDGFRB P09619 1/20 0.45
PDGFRA P16234 1/20 0.45
FLT1 P17948 1/20 0.45
FLT4 P35916 1/20 0.45
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL4996941 0.88 KDR (0.81) KDRFYNBRAFCAMK2DCDK1
SCHEMBL4995179 0.81 BRAF (0.52) KDRBRAFCDK1FGFR2TP53
SCHEMBL4997513 0.78 BRAF (0.83) BRAF
SCHEMBL4672282 0.78 KDR (1.00) KDRBRAFEGFRFGFR2GSK3A
SCHEMBL4996034 0.78 KDR (0.74) KDRBRAFCDK1EGFRFGFR2
SCHEMBL4992499 0.78 BRAF (0.60) KDRFYNBRAF
SCHEMBL1122300 0.77 BRAF (0.76) BRAF
SCHEMBL4987209 0.76 KDR (0.79) KDRBRAFCDK1EGFRFGFR2
SCHEMBL2889322 0.73 KCNH2 (0.49) KDRBRAFKCNH2SCN5ASCN9A
SCHEMBL2885535 0.73 KCNH2 (0.46) KDRBRAFKCNH2SCN5ASCN9A

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-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

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 KDR 2202/4885FYN 20/4885BRAF 478/4885

“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.