SCHEMBL4882519

SCHEMBL4882519

O=c1c(-n2cccn2)nc(Cl)c(-c2c(F)cccc2F)n1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 2/20 0.45
JAK2 O60674 1/20 0.39
TYK2 P29597 1/20 0.39
MAPK1 P28482 2/20 0.35
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
NOTUM Q6P988 1/20 0.35
KAT6A Q92794 1/20 0.34
BTK Q06187 1/20 0.34
MAPT P10636 3/20 0.33
TP53 P04637 2/20 0.33
HTT P42858 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ACLY P53396 1/20 0.33
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
LMNA P02545 1/20 0.33
ADORA2A P29274 1/20 0.33

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
SCHEMBL4882430 0.91 MAT2A (0.46) MAT2AJAK2TYK2MAPK1NPC1
SCHEMBL4877684 0.86 MAT2A (0.39) MAT2AJAK2TYK2MAPK1POLB
SCHEMBL4487964 0.83 JAK2 (0.40) MAT2AJAK2TYK2MAPK1NPC1
SCHEMBL3989631 0.78 JAK2 (0.39) MAT2AJAK2TYK2MAPK1NPC1
SCHEMBL3986451 0.78 JAK2 (0.36) MAT2AJAK2TYK2POLBNPSR1
SCHEMBL4261005 0.75 HRH3 (0.35) MAT2AKAT6ATP53HTTKDM4E
SCHEMBL4497287 0.75 HTR2A (0.36) MAT2AKDM4EALDH1A1
SCHEMBL3989442 0.75 NPBWR1 (0.41) JAK2TYK2MAPK1MAPTTP53
SCHEMBL13788904 0.74 MAT2A (0.42) MAT2AMAPK1NPC1NOTUMMAPT
SCHEMBL4501812 0.72 TYK2 (0.43) MAT2AJAK2TYK2MAPK1NPC1

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-20080194585-A1 Fungicidal Pyrazine Derivatives SHARPE PAULA LOUISE 2008-08-14 US claimed
EP-1848711-A1 FUNGICIDAL PYRAZINE DERIVATIVES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2007-10-31 EP claimed
WO-2006089060-A1 FUNGICIDAL PYRAZINE DERIVATIVES E.I. DUPONT DE NEMOURS AND COMPANY (US) 2006-08-24 WO claimed
US-20080194585-A1 Fungicidal Pyrazine Derivatives SHARPE PAULA LOUISE 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-20080194585-A1 Fungicidal Pyrazine Derivatives CBR3, CBR1, NR0B1 MAT2A 4013/4885JAK2 3907/4885TYK2 2617/4885

“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.