SCHEMBL4489145

SCHEMBL4489145

CCOc1ccccc1Oc1nc(Nc2cc(OC)c(OCCN3CCN(C)CC3)c(OC)c2)ncc1C(=O)Nc1c(C)cccc1C

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LCK P06239 11/20 0.61
JAK3 P52333 2/20 0.61
BTK Q06187 2/20 0.61
TNK2 Q07912 1/20 0.61
SRC P12931 12/20 0.50
KDR P35968 10/20 0.50
MAPK14 Q16539 5/20 0.49
MET P08581 2/20 0.46
JAK2 O60674 1/20 0.46
FGFR1 P11362 1/20 0.46
ZAP70 P43403 1/20 0.46
SYK P43405 1/20 0.46
TEK Q02763 1/20 0.46
ULK1 O75385 2/20 0.42
PRKAA2 P54646 1/20 0.42
PRKAA1 Q13131 1/20 0.42
ULK2 Q8IYT8 1/20 0.42
EGFR P00533 2/20 0.41
TTK P33981 1/20 0.41

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
SCHEMBL4495966 0.96 LCK (0.59) LCKJAK3BTKTNK2SRC
SCHEMBL4503811 0.92 LCK (0.59) LCKJAK3BTKTNK2SRC
SCHEMBL4485430 0.92 LCK (0.54) LCKJAK3BTKTNK2SRC
SCHEMBL4501652 0.89 LCK (0.57) LCKJAK3BTKTNK2SRC
SCHEMBL4501630 0.88 JAK3 (0.68) LCKJAK3BTKTNK2SRC
SCHEMBL5686167 0.88 LCK (0.53) LCKJAK3BTKTNK2SRC
SCHEMBL4487782 0.88 LCK (0.51) LCKJAK3BTKTNK2SRC
SCHEMBL4498991 0.88 LCK (0.52) LCKJAK3BTKTNK2SRC
SCHEMBL4506463 0.88 LCK (0.52) LCKJAK3BTKTNK2SRC
SCHEMBL4496708 0.88 LCK (0.51) LCKJAK3BTKTNK2SRC

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.