SCHEMBL2114214

SCHEMBL2114214

Cc1c(C(=O)c2ccccc2)c(C=C2C(=O)Nc3ccc(F)cc32)n(C(CC(N)=O)N2CCCC2)c1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 2/20 0.44
▸ KDR P35968 9/20 0.43
▸ PDGFRB P09619 8/20 0.43
▸ FGFR1 P11362 4/20 0.43
▸ TLK2 Q86UE8 3/20 0.43
▸ FLT3 P36888 6/20 0.42
▸ FLT1 P17948 3/20 0.41
▸ CSF1R P07333 2/20 0.41
▸ PDGFRA P16234 2/20 0.41
▸ KIT P10721 4/20 0.40
▸ PIM1 P11309 2/20 0.40
▸ PIM2 Q9P1W9 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ RIOK2 Q9BVS4 2/20 0.40
▸ TLK1 Q9UKI8 2/20 0.40
▸ PRKAA2 P54646 2/20 0.40
▸ PRKAA1 Q13131 2/20 0.40
▸ BMPR1B O00238 1/20 0.40
▸ PLK4 O00444 1/20 0.40

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
SCHEMBL2114261 0.91 CCNB2 (0.42) KDRPDGFRBFGFR1TLK2KIT
SCHEMBL2116265 0.91 PIM1 (0.39) ALKKDRPDGFRBFGFR1FLT3
SCHEMBL2117620 0.90 LRRK2 (0.40) ALKKDRPDGFRBFGFR1TLK2
SCHEMBL2116293 0.87 PDGFRB (0.43) KDRPDGFRBFGFR1CHEK1EGFR
SCHEMBL2115110 0.85 KDR (0.42) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL2116258 0.85 CCNB2 (0.40) ALKKDRPDGFRBFGFR1TLK2
SCHEMBL2117379 0.83 KDR (0.42) KDRPDGFRBFGFR1TLK2KIT
SCHEMBL2118661 0.77 KDR (0.41) ALKKDRPDGFRBFGFR1TLK2
SCHEMBL2117534 0.76 CCNB2 (0.42) KDRPDGFRBFGFR1TLK2KIT
SCHEMBL1673441 0.75 ALK (0.52) ALKKDRPDGFRBFGFR1TLK2

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 ALK 191/4885KDR 395/4885PDGFRB 555/4885

“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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