SCHEMBL2115629

SCHEMBL2115629

CCN(CC)C(O)CNC(=O)c1c[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT2 P31751 9/20 0.53
KDR P35968 9/20 0.51
FLT3 P36888 5/20 0.47
PRKAA1 Q13131 5/20 0.47
PDPK1 O15530 4/20 0.47
PDGFRB P09619 4/20 0.47
PRKAA2 P54646 4/20 0.47
CSF1R P07333 3/20 0.47
PLK4 O00444 2/20 0.47
DCLK1 O15075 2/20 0.47
DAPK3 O43293 2/20 0.47
ROCK2 O75116 2/20 0.47
RPS6KA5 O75582 2/20 0.47
RPS6KA4 O75676 2/20 0.47
MAP4K4 O95819 2/20 0.47
CHEK2 O96017 2/20 0.47
NTRK1 P04629 2/20 0.47
INSR P06213 2/20 0.47
LCK P06239 2/20 0.47
FYN P06241 2/20 0.47

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
SCHEMBL31216363 0.84 KDR (0.71) AKT2KDRFLT3PRKAA1PDPK1
SCHEMBL13755275 0.80 KDR (0.73) AKT2KDRFLT3PRKAA1PDPK1
SCHEMBL2114561 0.78 PAK4 (0.57) AKT2KDRFLT3PRKAA1PDPK1
SCHEMBL30454529 0.78 PDPK1 (0.60) AKT2KDRFLT3PDPK1NTRK1
SCHEMBL3799498 0.77 AKT2 (0.67) AKT2KDRFLT3PDPK1NTRK1
SCHEMBL14864981 0.70 FLT3 (0.63) AKT2KDRFLT3PRKAA1PDPK1
SCHEMBL5727779 0.70 AKT2 (1.00) AKT2PDPK1PDK1
SCHEMBL5727776 0.70 AKT2 (1.00) AKT2PDPK1PDK1
SCHEMBL5518067 0.69 KDR (0.77) AKT2KDRFLT3PRKAA1PDPK1
SCHEMBL13711983 0.69 KDR (0.77) AKT2KDRFLT3PRKAA1PDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120094998-A1 Oligomer-Protein Tyrosine Kinase Inhibitor Conjugates NEKTAR THERAPEUTICS (US) 2012-04-19 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-20120094998-A1 Oligomer-Protein Tyrosine Kinase Inhibitor Conjugates PTK2B, ERBB2, FRK AKT2 500/4885KDR 395/4885FLT3 111/4885

“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.