SCHEMBL3384590

SCHEMBL3384590

CN1CCc2cc(Nc3ncc(C4CC4)c(NCCC(N)=O)n3)ccc2C1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 3/20 0.74
ULK2 Q8IYT8 3/20 0.74
TBK1 Q9UHD2 6/20 0.56
PTK2 Q05397 1/20 0.50
SYK P43405 2/20 0.49
CHEK1 O14757 8/20 0.46
FLT3 P36888 8/20 0.46
CDK2 P24941 2/20 0.45
MARK3 P27448 1/20 0.45
IKBKE Q14164 1/20 0.45
BRSK2 Q8IWQ3 1/20 0.45
AURKB Q96GD4 1/20 0.45
MKNK1 Q9BUB5 1/20 0.45
AURKA O14965 1/20 0.45
RPS6KA5 O75582 1/20 0.45
RPS6KA4 O75676 1/20 0.45
KIT P10721 1/20 0.45
RPS6KB1 P23443 1/20 0.45
RPS6KA3 P51812 1/20 0.45
RPS6KA2 Q15349 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
SCHEMBL3385878 0.97 ULK1 (0.70) ULK1ULK2TBK1PTK2SYK
SCHEMBL27087860 0.88 ULK1 (0.73) ULK1ULK2TBK1SYKCHEK1
SCHEMBL3384595 0.87 ULK1 (0.75) ULK1ULK2TBK1CHEK1FLT3
SCHEMBL3385828 0.85 TBK1 (0.70) ULK1ULK2TBK1PTK2SYK
SCHEMBL3385882 0.84 ULK1 (0.71) ULK1ULK2TBK1CHEK1FLT3
SCHEMBL3384644 0.84 SYK (0.63) ULK1ULK2TBK1SYKCDK2
SCHEMBL13431972 0.84 ULK1 (1.00) ULK1ULK2TBK1CDK2MARK3
SCHEMBL27087849 0.84 ULK1 (0.73) ULK1ULK2TBK1CHEK1FLT3
SCHEMBL29989851 0.84 ULK1 (0.73) ULK1ULK2TBK1CHEK1FLT3
Hydrochloric Acid SCHEMBL30503001 0.83 ULK1 (0.98) ULK1ULK2TBK1CDK2MARK3

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 ULK1 2369/4885ULK2 1695/4885TBK1 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.