SCHEMBL4995501

SCHEMBL4995501

Cc1cc(C)cc(-c2cncc(N3CCN(c4ccccc4)CC3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.49
KDM4E B2RXH2 5/20 0.49
LMNA P02545 2/20 0.49
TSHR P16473 1/20 0.49
MAPK1 P28482 1/20 0.49
HSD17B10 Q99714 1/20 0.49
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
NPC1 O15118 1/20 0.47
GAA P10253 1/20 0.47
NFKB1 P19838 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GFER P55789 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
PIM2 Q9P1W9 6/20 0.45
RAD52 P43351 1/20 0.45

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
SCHEMBL4991478 0.90 CHEK1 (0.43) MAPTKDM4EALDH1A1SMN1; SMN2PIM2
SCHEMBL5000915 0.90 PIM2 (0.51) MAPTKDM4ELMNATSHRMAPK1
SCHEMBL4987930 0.89 RAD52 (0.42) MAPTNPC1GAARAB9APIM2
SCHEMBL4996260 0.88 CHEK1 (0.48) MAPTKDM4ELMNATSHRMAPK1
SCHEMBL4992145 0.87 MAPT (0.48) MAPTKDM4ELMNAMAPK1ALDH1A1
SCHEMBL4993281 0.86 MAPT (0.54) MAPTKDM4ELMNATSHRMAPK1
SCHEMBL4996226 0.85 CHEK1 (0.48) MAPTKDM4ELMNATSHRMAPK1
SCHEMBL5000886 0.82 MAPT (0.46) MAPTKDM4ELMNATSHRMAPK1
SCHEMBL5003034 0.82 PIM2 (0.48) MAPTKDM4ELMNATSHRMAPK1
SCHEMBL4993263 0.81 MAPT (0.47) MAPTKDM4ELMNATSHRMAPK1

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 MAPT 5/4885KDM4E 3445/4885LMNA 2743/4885

“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.