SCHEMBL5000886

SCHEMBL5000886

Cc1cc(C)cc(-c2cncc(N3CCN(c4ccc(Cl)c(Cl)c4)CC3)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
SMN1; SMN2 Q16637 6/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
LMNA P02545 2/20 0.46
ALOX12 P18054 1/20 0.46
HTT P42858 3/20 0.43
MAPK1 P28482 1/20 0.43
DHFR P00374 1/20 0.43
RAD52 P43351 1/20 0.42
ADRB1 P08588 1/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
DRD2 P14416 2/20 0.39
DRD4 P21917 2/20 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
SCHEMBL4991478 0.86 CHEK1 (0.43) MAPTSMN1; SMN2L3MBTL1DHFRRAD52
SCHEMBL4996975 0.83 CYP11B1 (0.45) MAPTSMN1; SMN2L3MBTL1LMNAALOX12
SCHEMBL4992145 0.82 MAPT (0.48) MAPTSMN1; SMN2LMNAHTTMAPK1
SCHEMBL5003159 0.82 DHFR (0.40) MAPTSMN1; SMN2L3MBTL1LMNAALOX12
SCHEMBL5003424 0.82 MAPT (0.43) MAPTSMN1; SMN2L3MBTL1LMNAALOX12
SCHEMBL4995501 0.82 MAPT (0.49) MAPTSMN1; SMN2LMNAHTTMAPK1
SCHEMBL4987930 0.82 RAD52 (0.42) MAPTDHFRRAD52RAB9ACLK2
SCHEMBL4994661 0.81 ACVR1 (0.42) MAPTHTTRAD52GAA
SCHEMBL5000821 0.81 MAPT (0.46) MAPTSMN1; SMN2LMNAHTTMAPK1
SCHEMBL4992120 0.80 THRB (0.41) MAPTSMN1; SMN2L3MBTL1LMNAALOX12

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 5/4885SMN1; SMN2 896/4885L3MBTL1 4837/4885

“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.