SCHEMBL2116248

SCHEMBL2116248

CCN(CC)C(C(N)=O)n1c(C)c(C(=O)O)c(C)c1C=C1C(=O)Nc2cc(-c3cc(Cl)cc(Cl)c3)ccc21

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 13/20 0.40
▸ FLT4 P35916 4/20 0.40
▸ FLT3 P36888 4/20 0.40
▸ PRKAA2 P54646 1/20 0.38
▸ PRKAA1 Q13131 1/20 0.38
▸ CHEK1 O14757 7/20 0.38
▸ PDGFRB P09619 8/20 0.37
▸ FGFR1 P11362 8/20 0.37
▸ EGFR P00533 6/20 0.37
▸ KIT P10721 2/20 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
SCHEMBL2114117 0.91 KDR (0.46) KDRFLT4FLT3CHEK1PDGFRB
SCHEMBL2114389 0.86 FLT3 (0.41) KDRFLT4FLT3CHEK1PDGFRB
SCHEMBL2114116 0.85 LRRK2 (0.42) KDRFLT4FLT3PRKAA2PRKAA1
SCHEMBL2118752 0.82 KDR (0.46) KDRFLT4FLT3PRKAA1CHEK1
SCHEMBL2116963 0.81 PDGFRB (0.46) KDRPRKAA2PRKAA1PDGFRBFGFR1
SCHEMBL722802 0.81 ALK (0.52) KDRFLT4FLT3PRKAA2PRKAA1
SCHEMBL399058 0.81 FLT3 (0.48) KDRFLT4FLT3PDGFRBKIT
SCHEMBL2113982 0.80 KDR (0.47) KDRFLT4FLT3CHEK1PDGFRB
SCHEMBL2115792 0.79 NTRK1 (0.43) KDRFLT3PDGFRBFGFR1EGFR
SCHEMBL2116213 0.79 FGFR1 (0.51) KDRFLT4FLT3CHEK1PDGFRB

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 395/4885FLT4 345/4885FLT3 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.

Send feedback