SCHEMBL4124627

SCHEMBL4124627

Cc1cn(-c2cc(C(=O)Nc3cccc(NC(=O)Nc4ccc5c(c4)NC(=O)/C5=C\c4[nH]c(C)c(C(=O)O)c4C)c3)cc(C(F)(F)F)c2)cn1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 6/20 0.71
▸ NTRK2 Q16620 6/20 0.69
▸ RAF1 P04049 2/20 0.69
▸ AURKA O14965 1/20 0.69
▸ SRC P12931 1/20 0.69
▸ FLT3 P36888 6/20 0.60
▸ FLT4 P35916 4/20 0.60
▸ KDR P35968 4/20 0.60
▸ KIT P10721 2/20 0.60
▸ AURKB Q96GD4 4/20 0.54
▸ CSF1R P07333 3/20 0.53
▸ BRAF P15056 1/20 0.48

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
SCHEMBL4002779 1.00 NTRK1 (0.71) NTRK1NTRK2RAF1AURKASRC
SCHEMBL396703 0.96 NTRK1 (0.76) NTRK1NTRK2RAF1AURKASRC
SCHEMBL396704 0.96 NTRK1 (0.76) NTRK1NTRK2RAF1AURKASRC
SCHEMBL397409 0.95 NTRK1 (0.69) NTRK1NTRK2RAF1AURKASRC
SCHEMBL397408 0.95 NTRK1 (0.69) NTRK1NTRK2RAF1AURKASRC
SCHEMBL10091887 0.91 NTRK2 (0.69) NTRK1NTRK2RAF1AURKASRC
SCHEMBL396340 0.91 NTRK2 (0.69) NTRK1NTRK2RAF1AURKASRC
SCHEMBL10091867 0.90 CSF1R (0.65) NTRK1NTRK2RAF1AURKASRC
SCHEMBL395674 0.90 CSF1R (0.65) NTRK1NTRK2RAF1AURKASRC
SCHEMBL4553352 0.90 NTRK1 (0.58) NTRK1NTRK2RAF1AURKASRC

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1814545-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-06-10 — — EP claimed
US-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-11 — — US claimed
EP-1814545-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2007-08-08 — — EP claimed
WO-2006052936-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-18 — — WO claimed
EP-1814545-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-06-10 — — EP disclosed
US-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-11 — — US disclosed
EP-1814545-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2007-08-08 — — EP disclosed
WO-2006052936-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-18 — — WO 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-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors BMX, FRK, PTK2B NTRK1 226/4885NTRK2 235/4885RAF1 109/4885

“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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