SCHEMBL4496142

SCHEMBL4496142

CCN(CC)C(=O)c1ccc(Oc2nc(Nc3ccc(N4CCN(C(C)C)CC4)cc3)ncc2C(=O)Nc2c(C)cccc2C)c(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LCK P06239 8/20 0.58
JAK3 P52333 2/20 0.58
BTK Q06187 1/20 0.58
TNK2 Q07912 1/20 0.58
KDR P35968 2/20 0.45
MAPK14 Q16539 2/20 0.45
TEK Q02763 1/20 0.45
SRC P12931 7/20 0.43
FGFR1 P11362 3/20 0.43
NTRK1 P04629 1/20 0.42
LYN P07948 1/20 0.42
BRD4 O60885 1/20 0.40
CSF1R P07333 1/20 0.40
DAPK1 P53355 1/20 0.40
HCK P08631 1/20 0.40
TTK P33981 2/20 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
SCHEMBL4490903 0.93 LCK (0.60) LCKJAK3BTKTNK2KDR
SCHEMBL4509205 0.92 LCK (0.57) LCKJAK3BTKTNK2KDR
SCHEMBL4498281 0.89 LCK (0.58) LCKJAK3BTKTNK2KDR
SCHEMBL4500680 0.89 LCK (0.58) LCKJAK3BTKTNK2KDR
SCHEMBL4505399 0.88 LCK (0.55) LCKJAK3BTKTNK2KDR
SCHEMBL4496116 0.88 LCK (0.57) LCKJAK3BTKTNK2KDR
SCHEMBL4496113 0.88 LCK (0.57) LCKJAK3BTKTNK2KDR
SCHEMBL4508707 0.87 LCK (0.60) LCKJAK3BTKTNK2KDR
SCHEMBL4497672 0.87 LCK (0.56) LCKJAK3BTKTNK2KDR
SCHEMBL4481579 0.87 LCK (0.59) LCKJAK3BTKTNK2KDR

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.