SCHEMBL2114207

SCHEMBL2114207

Cc1[nH]c(C=C2C(=O)Nc3cc(-c4ccccc4)ccc32)c(C)c1C(=O)NCCN1CCCC1

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.70
PDGFRB P09619 6/20 0.70
FGFR1 P11362 5/20 0.70
TLK2 Q86UE8 2/20 0.70
FLT3 P36888 3/20 0.67
AURKB Q96GD4 2/20 0.67
MET P08581 1/20 0.67
CHEK1 O14757 5/20 0.61
KIT P10721 2/20 0.60
AURKA O14965 1/20 0.60
LCK P06239 1/20 0.60
KCNH2 Q12809 1/20 0.60
EGFR P00533 1/20 0.58
PRKAA1 Q13131 8/20 0.56
PRKAA2 P54646 7/20 0.56
FLT4 P35916 1/20 0.51
PIM1 P11309 1/20 0.51

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
SCHEMBL31672506 1.00 KDR (0.70) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL13755214 1.00 KDR (0.70) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL2114494 0.93 KDR (0.78) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL13755201 0.93 KDR (0.78) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL5518802 0.92 KDR (0.68) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL2114656 0.92 KDR (0.68) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL2114979 0.91 KDR (0.65) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL13755226 0.91 KDR (0.65) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL13755236 0.91 KDR (0.65) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL2116230 0.91 KDR (0.65) KDRPDGFRBFGFR1TLK2FLT3

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 KDR 395/4885PDGFRB 555/4885FGFR1 462/4885

“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.