SCHEMBL4493975

SCHEMBL4493975

Cc1cccc(C)c1NC(=O)c1cnc(Nc2ccc(N3CCN(C(C)C)CC3)c(Cl)c2)nc1Oc1cccc(CCC(N)=O)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 3/20 0.45
LCK P06239 1/20 0.45
BTK Q06187 1/20 0.45
TNK2 Q07912 1/20 0.45
SRC P12931 7/20 0.43
SIK1 P57059 2/20 0.42
SIK2 Q9H0K1 2/20 0.42
SIK3 Q9Y2K2 2/20 0.42
SYK P43405 3/20 0.40
EGFR P00533 4/20 0.39
JAK2 O60674 1/20 0.39
BLK P51451 1/20 0.39
BMX P51813 1/20 0.39
ITK Q08881 1/20 0.38
HCK P08631 1/20 0.37
FGFR1 P11362 1/20 0.37
PAK1 Q13153 1/20 0.37

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
SCHEMBL4499562 0.91 JAK3 (0.55) JAK3LCKBTKTNK2SRC
SCHEMBL4491097 0.87 BTK (0.49) JAK3LCKBTKTNK2SRC
SCHEMBL4480467 0.86 JAK3 (0.48) JAK3LCKBTKTNK2SRC
SCHEMBL4491813 0.86 SIK1 (0.58) JAK3LCKBTKTNK2SRC
SCHEMBL4490043 0.84 LCK (0.48) JAK3LCKBTKTNK2SRC
SCHEMBL4494021 0.83 LCK (0.49) JAK3LCKBTKTNK2SRC
SCHEMBL4496325 0.83 JAK3 (0.57) JAK3LCKBTKTNK2SRC
SCHEMBL4508239 0.83 LCK (0.65) JAK3LCKBTKTNK2SRC
SCHEMBL4496211 0.81 LCK (0.54) JAK3LCKBTKTNK2SRC
SCHEMBL4495504 0.80 LCK (0.48) JAK3LCKBTKTNK2SRC

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 JAK3 900/4885LCK 33/4885BTK 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.