SCHEMBL4497083

SCHEMBL4497083

CCN(CC)C(=O)CCc1cccc(Oc2nc(Nc3ccc(N4CCN(C)CC4)c(OC)c3)ncc2C(=O)Nc2c(C)cccc2C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.49
JAK3 P52333 1/20 0.49
BTK Q06187 1/20 0.49
TNK2 Q07912 1/20 0.49
PAK1 Q13153 5/20 0.48
SIK1 P57059 2/20 0.47
SIK2 Q9H0K1 2/20 0.47
SIK3 Q9Y2K2 2/20 0.47
SRC P12931 2/20 0.45
KDR P35968 1/20 0.45
MAPK14 Q16539 1/20 0.45
PKMYT1 Q99640 1/20 0.44
EGFR P00533 3/20 0.44
ALK Q9UM73 1/20 0.44
TNIK Q9UKE5 1/20 0.43
NUAK2 Q9H093 2/20 0.43
FGFR3 P22607 3/20 0.43
TTK P33981 1/20 0.43
NUAK1 O60285 1/20 0.43
BRD4 O60885 1/20 0.42

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
SCHEMBL4499962 0.92 EGFR (0.48) LCKJAK3BTKTNK2PAK1
SCHEMBL4486716 0.92 SIK1 (0.57) LCKJAK3BTKTNK2PAK1
SCHEMBL4498329 0.90 JAK3 (0.59) LCKJAK3BTKTNK2SRC
SCHEMBL4508877 0.88 SIK1 (0.55) LCKJAK3BTKTNK2PAK1
SCHEMBL4488816 0.88 SIK1 (0.55) LCKJAK3BTKTNK2PAK1
SCHEMBL4499608 0.87 LCK (0.48) LCKJAK3BTKTNK2SRC
SCHEMBL4496460 0.86 SIK1 (0.55) LCKJAK3BTKTNK2PAK1
SCHEMBL4508084 0.86 PAK1 (0.54) LCKJAK3BTKTNK2PAK1
SCHEMBL4499343 0.86 TBK1 (0.45) LCKJAK3BTKTNK2SRC
SCHEMBL4495346 0.86 LCK (0.60) LCKJAK3BTKTNK2SIK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 US claimed
US-7504396-B2 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2009-03-17 US disclosed
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 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-20050209221-A1 Substituted heterocyclic compounds and methods of use ICOS, CD4, HLA-DRB1 LCK 33/4885JAK3 900/4885BTK 1420/4885

“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.