SCHEMBL5000701

SCHEMBL5000701

Fc1ccccc1N1CCN(c2cncc(-c3ccc4ccccc4c3)n2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 2/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
CYP11B1 P15538 1/20 0.50
CYP11B2 P19099 1/20 0.50
PIM1 P11309 5/20 0.46
PIM3 Q86V86 5/20 0.46
PIM2 Q9P1W9 5/20 0.46
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
ALDH1A1 P00352 3/20 0.42
NPC1 O15118 1/20 0.42
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 1/20 0.42
KDM4E B2RXH2 2/20 0.40

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
SCHEMBL4997591 0.90 CYP11B1 (0.47) LMNASMN1; SMN2MAPTNFKB1NFKB2
SCHEMBL4992191 0.86 MAPT (0.54) LMNASMN1; SMN2MAPTNFKB1NFKB2
SCHEMBL4994571 0.85 SMN1; SMN2 (0.51) LMNASMN1; SMN2MAPTNFKB1NFKB2
SCHEMBL4997577 0.85 CYP11B2 (0.53) LMNASMN1; SMN2MAPTNFKB1NFKB2
SCHEMBL4992184 0.84 MAPT (0.52) LMNASMN1; SMN2MAPTNFKB1NFKB2
SCHEMBL4996961 0.83 MEN1 (0.51) LMNAMAPTCYP11B1CYP11B2PIM1
SCHEMBL4997488 0.83 LMNA (0.50) LMNASMN1; SMN2MAPTNFKB1NFKB2
SCHEMBL4997627 0.82 NPC1 (0.55) LMNASMN1; SMN2MAPTNFKB1NFKB2
SCHEMBL4993263 0.82 MAPT (0.47) LMNASMN1; SMN2MAPTNFKB1NFKB2
SCHEMBL4996249 0.82 MAPT (0.50) LMNASMN1; SMN2MAPTNFKB1NFKB2

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 2743/4885SMN1; SMN2 896/4885MAPT 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.