SCHEMBL4489101

SCHEMBL4489101

COc1cccc(OC)c1Oc1nc(Nc2ccc(OCCCN3CCCCC3)c(F)c2)ncc1C(=O)Nc1c(C)cccc1C

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.54
KDR P35968 3/20 0.54
SRC P12931 2/20 0.54
MAPK14 Q16539 2/20 0.54
TNK2 Q07912 3/20 0.53
BTK Q06187 3/20 0.49
JAK3 P52333 2/20 0.49
MET P08581 10/20 0.46
SIK1 P57059 2/20 0.44
SIK2 Q9H0K1 2/20 0.44
SIK3 Q9Y2K2 2/20 0.44
IGF1R P08069 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
SCHEMBL4507099 0.95 TNK2 (0.54) LCKKDRSRCMAPK14TNK2
SCHEMBL4496682 0.94 LCK (0.54) LCKKDRSRCMAPK14TNK2
SCHEMBL4494943 0.93 TNK2 (0.53) LCKKDRSRCMAPK14TNK2
SCHEMBL4502533 0.93 LCK (0.51) LCKKDRSRCMAPK14TNK2
SCHEMBL4487084 0.92 LCK (0.56) LCKKDRSRCMAPK14TNK2
SCHEMBL4508413 0.91 TNK2 (0.52) LCKKDRSRCMAPK14TNK2
SCHEMBL4495349 0.91 TNK2 (0.52) LCKKDRSRCMAPK14TNK2
SCHEMBL4490886 0.91 TNK2 (0.52) LCKKDRSRCMAPK14TNK2
SCHEMBL4490742 0.90 LCK (0.56) LCKKDRSRCMAPK14TNK2
SCHEMBL4498854 0.90 TNK2 (0.52) LCKKDRSRCMAPK14TNK2

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.