SCHEMBL4491969

SCHEMBL4491969

COc1cccc(Oc2nc(Nc3cc(OC)c(OCCCN4CCN(C)CC4)c(OC)c3)ncc2C(=O)Nc2c(Cl)cccc2Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.49
KDR P35968 4/20 0.49
SRC P12931 3/20 0.49
MAPK14 Q16539 2/20 0.49
JAK2 O60674 2/20 0.49
FGFR1 P11362 2/20 0.49
JAK3 P52333 2/20 0.49
BTK Q06187 2/20 0.49
MET P08581 1/20 0.49
ZAP70 P43403 1/20 0.49
SYK P43405 1/20 0.49
TEK Q02763 1/20 0.49
EGFR P00533 13/20 0.49
TBK1 Q9UHD2 1/20 0.46
NUAK1 O60285 2/20 0.46
NUAK2 Q9H093 2/20 0.46
ITK Q08881 2/20 0.44
PLK4 O00444 1/20 0.44
GAK O14976 1/20 0.44
FLT3 P36888 1/20 0.44

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
SCHEMBL4488905 0.95 EGFR (0.48) LCKKDRSRCMAPK14JAK2
SCHEMBL4495029 0.93 KDR (0.47) LCKKDRSRCMAPK14JAK2
SCHEMBL4496342 0.92 JAK3 (0.51) LCKKDRSRCMAPK14JAK3
SCHEMBL4481353 0.92 LCK (0.47) LCKKDRSRCMAPK14JAK2
SCHEMBL4489317 0.90 CSF1R (0.47) LCKKDRSRCMAPK14JAK2
SCHEMBL4490254 0.89 KDR (0.50) LCKKDRSRCMAPK14JAK3
SCHEMBL4493387 0.88 LCK (0.52) LCKKDRSRCMAPK14JAK2
SCHEMBL4498991 0.87 LCK (0.52) LCKKDRSRCMAPK14JAK2
SCHEMBL4509912 0.85 LCK (0.55) LCKKDRSRCMAPK14JAK2
SCHEMBL4497860 0.84 JAK3 (0.52) LCKKDRSRCMAPK14JAK3

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 33/4885KDR 3785/4885SRC 2472/4885

“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.