SCHEMBL4501586

SCHEMBL4501586

CCN(CC)C(=O)c1ccc(Oc2nc(Nc3ccc(OCCCN4CCCCC4)c(F)c3)ncc2C(=O)Nc2ccc(F)c(F)c2F)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 2/20 0.40
BTK Q06187 2/20 0.40
KDR P35968 2/20 0.39
LCK P06239 1/20 0.39
SRC P12931 1/20 0.39
MAPK14 Q16539 1/20 0.39
EGFR P00533 6/20 0.38
MET P08581 1/20 0.38
TNK2 Q07912 2/20 0.38
INSR P06213 1/20 0.38
AXL P30530 1/20 0.38
BCHE P06276 1/20 0.37
CNR2 P34972 1/20 0.37
CSF1R P07333 2/20 0.37
AURKA O14965 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
FLT1 P17948 1/20 0.36
FLT4 P35916 1/20 0.36

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
SCHEMBL4493926 0.95 CSF1R (0.41) JAK3BTKKDRLCKSRC
SCHEMBL4496514 0.93 JAK3 (0.42) JAK3BTKKDRLCKSRC
SCHEMBL4499640 0.92 KDR (0.41) JAK3BTKKDRLCKSRC
SCHEMBL4500176 0.91 MET (0.42) JAK3BTKKDRLCKSRC
SCHEMBL5686187 0.90 JAK3 (0.40) JAK3BTKKDRLCKSRC
SCHEMBL4496212 0.90 JAK3 (0.40) JAK3BTKKDRLCKSRC
SCHEMBL4484725 0.90 TNK2 (0.44) JAK3BTKKDRLCKSRC
SCHEMBL4496807 0.89 TNK2 (0.42) JAK3BTKKDRLCKSRC
SCHEMBL5689464 0.89 TNK2 (0.42) JAK3BTKKDRLCKSRC
SCHEMBL4506311 0.89 TNK2 (0.47) JAK3BTKKDRLCKSRC

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 900/4885BTK 1420/4885KDR 3785/4885

“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.