SCHEMBL3388073

SCHEMBL3388073

N#Cc1cccc(Nc2ncc(C3CC3)c(NCCC(N)=O)n2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.54
ZAP70 P43403 1/20 0.54
TBK1 Q9UHD2 10/20 0.52
PDPK1 O15530 1/20 0.52
IGF1R P08069 1/20 0.49
MARK3 P27448 2/20 0.48
MARK4 Q96L34 2/20 0.48
STK17A Q9UEE5 2/20 0.48
ULK1 O75385 2/20 0.47
ULK2 Q8IYT8 2/20 0.47
NUAK1 O60285 1/20 0.46
PRKAA2 P54646 1/20 0.46
SIK1 P57059 1/20 0.46
PRKAA1 Q13131 1/20 0.46
IKBKE Q14164 1/20 0.46
MELK Q14680 1/20 0.46
PDK1 Q15118 1/20 0.46
MARK2 Q7KZI7 1/20 0.46
NUAK2 Q9H093 1/20 0.46
SIK2 Q9H0K1 1/20 0.46

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
SCHEMBL3386107 0.88 TBK1 (0.56) SYKTBK1PDPK1IGF1RMARK3
SCHEMBL3384277 0.87 ULK1 (0.51) TBK1PDPK1MARK3MARK4STK17A
SCHEMBL3389588 0.86 TBK1 (0.54) SYKTBK1PDPK1IGF1RMARK3
SCHEMBL3383879 0.86 TBK1 (0.69) SYKTBK1PDPK1MARK3MARK4
SCHEMBL3389513 0.86 TBK1 (0.54) SYKTBK1PDPK1IGF1RMARK3
SCHEMBL3388078 0.86 SYK (0.54) SYKZAP70TBK1PDPK1IGF1R
SCHEMBL3389484 0.85 TBK1 (0.55) SYKZAP70TBK1PDPK1MARK3
SCHEMBL3384474 0.85 ULK1 (0.54) SYKTBK1PDPK1MARK3MARK4
SCHEMBL3387175 0.84 ULK1 (0.53) SYKTBK1PDPK1IGF1RMARK3
SCHEMBL3388911 0.84 TBK1 (0.55) SYKTBK1PDPK1MARK3MARK4

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-20100056524-A1 Compound MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-03-04 US disclosed

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-20100056524-A1 Compound NR3C2, NR3C1, NR2E3 SYK 627/4885ZAP70 1851/4885TBK1 2898/4885

“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.