SCHEMBL4501964

SCHEMBL4501964

COc1cc(-c2ccc3[nH]ccc3c2)ccc1Oc1nc(Nc2cc(OC)c(OC)c(OC)c2)ncc1C(=O)Nc1c(C)cccc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 2/20 0.46
LCK P06239 2/20 0.46
JAK3 P52333 1/20 0.46
TNK2 Q07912 1/20 0.46
ULK1 O75385 3/20 0.44
PRKAA2 P54646 1/20 0.44
PRKAA1 Q13131 1/20 0.44
ULK2 Q8IYT8 1/20 0.44
POLQ O75417 1/20 0.42
TNIK Q9UKE5 1/20 0.42
PTK2 Q05397 2/20 0.41
FGFR1 P11362 1/20 0.41
FGFR2 P21802 1/20 0.41
FGFR4 P22455 1/20 0.41
FGFR3 P22607 1/20 0.41
JAK2 O60674 1/20 0.41
EGFR P00533 2/20 0.41
MAP3K11 Q16584 2/20 0.41
LRRK2 Q5S007 1/20 0.41
NAE1 Q13564 1/20 0.40

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
SCHEMBL4485125 0.88 ULK1 (0.47) BTKLCKJAK3TNK2ULK1
SCHEMBL4496367 0.87 ULK1 (0.49) BTKLCKJAK3TNK2ULK1
SCHEMBL4499876 0.87 ULK1 (0.47) BTKLCKJAK3TNK2ULK1
SCHEMBL4496241 0.86 PRKCA (0.51) BTKLCKJAK3TNK2ULK1
SCHEMBL4503872 0.86 ULK1 (0.49) BTKLCKJAK3TNK2ULK1
SCHEMBL4492474 0.85 ULK1 (0.46) BTKLCKJAK3TNK2ULK1
SCHEMBL4497347 0.85 ULK1 (0.46) BTKLCKJAK3TNK2ULK1
SCHEMBL4498711 0.85 PLK1 (0.47) BTKLCKJAK3TNK2ULK1
SCHEMBL4490938 0.84 CYP2C9 (0.49) BTKLCKJAK3TNK2ULK1
SCHEMBL4565004 0.84 ULK1 (0.58) BTKLCKJAK3TNK2ULK1

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 BTK 1420/4885LCK 33/4885JAK3 900/4885

“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.