SCHEMBL5000611

SCHEMBL5000611

c1ccc2c(-c3cncc(N4CCN(c5cnccn5)CC4)n3)cccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPK1 P28482 2/20 0.43
MAPK3 P27361 1/20 0.43
PTPN11 Q06124 1/20 0.43
MAPT P10636 3/20 0.43
SORD Q00796 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SLC6A7 Q99884 1/20 0.42
CYP11B2 P19099 2/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
RIPK3 Q9Y572 1/20 0.40
DRD4 P21917 1/20 0.40
PIM1 P11309 1/20 0.39
PIM3 Q86V86 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
KARS1 Q15046 1/20 0.39
CYP11B1 P15538 1/20 0.39

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
SCHEMBL4993024 0.85 RIPK3 (0.44) LMNAMAPK1MAPK3PTPN11MAPT
SCHEMBL5003446 0.84 MAPT (0.47) LMNAMAPK1MAPK3PTPN11MAPT
SCHEMBL4997060 0.81 ALDH1A1 (0.46) LMNAL3MBTL1MAPK1MAPTSORD
SCHEMBL5002992 0.80 MAPT (0.51) LMNAMAPK1MAPK3PTPN11MAPT
SCHEMBL4997507 0.80 MAPK1 (0.42) L3MBTL1MAPK1MAPK3PTPN11MAPT
SCHEMBL4987334 0.78 NPC1 (0.45) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4993557 0.78 CCNT1 (0.41) L3MBTL1MAPK1MAPK3PTPN11MAPT
SCHEMBL5003014 0.77 MAPT (0.51) LMNAL3MBTL1MAPK1MAPK3PTPN11
SCHEMBL532788 0.77 MAPT (0.51) L3MBTL1MAPK1MAPTMEN1KMT2A
SCHEMBL4996244 0.76 PIM1 (0.39) LMNAMAPK1MAPK3PTPN11MAPT

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 1 patent. 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

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 LMNA 2743/4885L3MBTL1 4837/4885MAPK1 545/4885

“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.