SCHEMBL5000719

SCHEMBL5000719

Fc1ccc(-c2cncc(N3CCN(c4cccc(Cl)c4)CC3)n2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
GAA P10253 1/20 0.43
GFER P55789 1/20 0.43
PIM2 Q9P1W9 4/20 0.42
RAD52 P43351 1/20 0.42
DHFR P00374 1/20 0.42
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
ALOX12 P18054 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PIM1 P11309 1/20 0.41
PIM3 Q86V86 1/20 0.41
ABCG2 Q9UNQ0 1/20 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
SCHEMBL5000830 0.88 MEN1 (0.45) CYP11B1CYP11B2MEN1KMT2AGAA
SCHEMBL5003298 0.88 MAPT (0.44) CYP11B1CYP11B2MEN1KMT2APIM2
SCHEMBL4992156 0.86 CYP11B1 (0.49) CYP11B1CYP11B2PIM2RAD52PIM1
SCHEMBL4994785 0.85 SLC6A2 (0.47) MEN1KMT2AGAAGFERPIM2
SCHEMBL5000893 0.84 ABCG2 (0.52) MEN1KMT2AGAAGFERPIM2
SCHEMBL4997662 0.84 CYP11B1 (0.46) CYP11B1CYP11B2PIM2RAD52MAPT
SCHEMBL4993619 0.84 DHFR (0.46) MEN1KMT2AGAAGFERPIM2
SCHEMBL4995172 0.83 PIM1 (0.48) MEN1KMT2AGAAGFERPIM2
SCHEMBL5000887 0.82 CHEK1 (0.47) CYP11B1CYP11B2PIM2MAPTALDH1A1
SCHEMBL4997510 0.81 MAPT (0.60) MEN1KMT2AGAAMAPTALDH1A1

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 CYP11B1 132/4885CYP11B2 112/4885MEN1 1557/4885

“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.