SCHEMBL2115110

SCHEMBL2115110

COc1ccc2c(c1)NC(=O)C2=Cc1c(C(=O)c2ccccc2)c(C)c(C(=O)O)n1C(CC(N)=O)N1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 13/20 0.42
▸ PDGFRB P09619 10/20 0.42
▸ FGFR1 P11362 7/20 0.42
▸ SRC P12931 3/20 0.42
▸ FLT3 P36888 7/20 0.39
▸ KIT P10721 4/20 0.39
▸ FLT4 P35916 3/20 0.39
▸ AURKB Q96GD4 5/20 0.38
▸ AURKA O14965 3/20 0.38
▸ MET P08581 2/20 0.38
▸ AURKC Q9UQB9 1/20 0.38
▸ TLK2 Q86UE8 1/20 0.38
▸ EGFR P00533 2/20 0.38
▸ PDGFRA P16234 1/20 0.37
▸ LCK P06239 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37

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
SCHEMBL2117620 0.94 LRRK2 (0.40) KDRPDGFRBFGFR1SRCTLK2
SCHEMBL2116293 0.90 PDGFRB (0.43) KDRPDGFRBFGFR1SRCEGFR
SCHEMBL2116265 0.90 PIM1 (0.39) KDRPDGFRBFGFR1SRCFLT3
SCHEMBL2114214 0.85 ALK (0.44) KDRPDGFRBFGFR1SRCFLT3
SCHEMBL2114261 0.85 CCNB2 (0.42) KDRPDGFRBFGFR1SRCKIT
SCHEMBL2116258 0.79 CCNB2 (0.40) KDRPDGFRBFGFR1SRCFLT3
SCHEMBL2117379 0.77 KDR (0.42) KDRPDGFRBFGFR1SRCKIT
SCHEMBL397251 0.76 FLT3 (0.46) KDRPDGFRBFLT3KITFLT4
SCHEMBL397416 0.73 NTRK1 (0.51) KDRSRCFLT3KITFLT4
SCHEMBL393968 0.72 NTRK1 (0.44) KDRSRCFLT3KITFLT4

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-20120094998-A1 Oligomer-Protein Tyrosine Kinase Inhibitor Conjugates NEKTAR THERAPEUTICS (US) 2012-04-19 — — US disclosed
EP-1536783-B1 SOLID FORMULATIONS COMPRISING AN INDOLINONE COMPOUND PFIZER ITALIA SRL (IT) 2008-08-06 — — EP 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.

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