SCHEMBL5000610

SCHEMBL5000610

OCc1ccc(-c2cncc(N3CCN(c4ccccn4)CC3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SORD Q00796 1/20 0.51
LMNA P02545 4/20 0.48
MAPT P10636 3/20 0.48
MAPK1 P28482 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
TP53 P04637 2/20 0.48
HTT P42858 1/20 0.48
KDM4E B2RXH2 6/20 0.47
ALDH1A1 P00352 4/20 0.47
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CHRNA7 P36544 1/20 0.45
TSHR P16473 2/20 0.44
HSD17B10 Q99714 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HPGD P15428 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
SCHEMBL4997711 0.85 SORD (0.47) SORDMAPTNPC1RAB9AHTT
SCHEMBL4997684 0.84 BCHE (0.54) LMNAMAPTMAPK1NPC1RAB9A
SCHEMBL5003471 0.84 MAPT (0.54) LMNAMAPTMAPK1NPC1RAB9A
SCHEMBL5000896 0.84 DRD2 (0.58) LMNAMAPTMAPK1NPC1RAB9A
SCHEMBL4995037 0.82 FYN (0.43) SORDMAPT
SCHEMBL5002975 0.81 CHEK1 (0.55) LMNAMAPTMAPK1NPC1RAB9A
SCHEMBL4997188 0.81 HRH3 (0.53) LMNAMAPTMAPK1NPC1RAB9A
SCHEMBL4996845 0.81 MAPT (0.49) LMNAMAPTMAPK1NPC1HTT
SCHEMBL4997696 0.81 CHEK1 (0.53) LMNAMAPTMAPK1NPC1RAB9A
SCHEMBL4995301 0.81 MAPK1 (0.51) LMNAMAPTMAPK1NPC1RAB9A

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 SORD 233/4885LMNA 2743/4885MAPT 5/4885

“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.