SCHEMBL4499640

SCHEMBL4499640

CCN(CC)C(=O)c1ccc(Oc2nc(Nc3ccc(OCCCN4CCCCC4)c(F)c3)ncc2C(=O)Nc2ccc(C)c(C)c2C)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.41
LCK P06239 4/20 0.41
MAPK14 Q16539 3/20 0.41
SRC P12931 2/20 0.41
TNK2 Q07912 2/20 0.40
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
JAK3 P52333 3/20 0.39
BTK Q06187 2/20 0.39
MET P08581 3/20 0.38
BRD4 O60885 1/20 0.37
JAK1 P23458 1/20 0.37
HDAC1 Q13547 1/20 0.37
AXL P30530 2/20 0.37
INSR P06213 1/20 0.37
EGFR P00533 1/20 0.37
TEK Q02763 1/20 0.36
BCHE P06276 1/20 0.36
CNR2 P34972 1/20 0.36
HTR2A P28223 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
SCHEMBL4503818 0.95 LCK (0.43) KDRLCKMAPK14SRCJAK3
SCHEMBL4501586 0.92 JAK3 (0.40) KDRLCKMAPK14SRCTNK2
SCHEMBL4496514 0.92 JAK3 (0.42) KDRLCKMAPK14SRCTNK2
SCHEMBL4496807 0.90 TNK2 (0.42) KDRLCKMAPK14SRCTNK2
SCHEMBL5689464 0.90 TNK2 (0.42) KDRLCKMAPK14SRCTNK2
SCHEMBL4506311 0.90 TNK2 (0.47) KDRLCKMAPK14SRCTNK2
SCHEMBL4500176 0.90 MET (0.42) KDRLCKMAPK14SRCTNK2
SCHEMBL4496212 0.89 JAK3 (0.40) KDRLCKMAPK14SRCTNK2
SCHEMBL4484725 0.89 TNK2 (0.44) KDRLCKMAPK14SRCTNK2
SCHEMBL5686187 0.89 JAK3 (0.40) KDRLCKMAPK14SRCTNK2

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 KDR 3785/4885LCK 33/4885MAPK14 3248/4885

“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.