SCHEMBL2116293

SCHEMBL2116293

Cc1c(C(=O)c2ccccc2)c(C=C2C(=O)Nc3cc(-c4ccccc4)ccc32)n(C(CC(N)=O)N2CCCC2)c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 11/20 0.43
▸ FGFR1 P11362 10/20 0.43
▸ KDR P35968 10/20 0.43
▸ EGFR P00533 7/20 0.43
▸ SRC P12931 3/20 0.41
▸ CHEK1 O14757 8/20 0.39
▸ CDK2 P24941 1/20 0.35

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
SCHEMBL2116265 0.91 PIM1 (0.39) PDGFRBFGFR1KDRSRCCHEK1
SCHEMBL2115110 0.90 KDR (0.42) PDGFRBFGFR1KDREGFRSRC
SCHEMBL2114261 0.87 CCNB2 (0.42) PDGFRBFGFR1KDREGFRSRC
SCHEMBL2114214 0.87 ALK (0.44) PDGFRBFGFR1KDREGFRSRC
SCHEMBL2117620 0.85 LRRK2 (0.40) PDGFRBFGFR1KDRSRCCDK2
SCHEMBL2116258 0.81 CCNB2 (0.40) PDGFRBFGFR1KDREGFRSRC
SCHEMBL2117379 0.78 KDR (0.42) PDGFRBFGFR1KDREGFRSRC
SCHEMBL397251 0.77 FLT3 (0.46) PDGFRBKDR
SCHEMBL2114212 0.77 KDR (0.44) PDGFRBFGFR1KDREGFRSRC
SCHEMBL397416 0.74 NTRK1 (0.51) KDRSRC

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

“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.

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