SCHEMBL1024939

SCHEMBL1024939

CC(C)(C)OC(=O)Nc1ccc(Nc2nc(Cl)ncc2F)cc1CCc1cncc(NC(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.42
P2RX3 P56373 3/20 0.38
ITK Q08881 7/20 0.37
EGFR P00533 8/20 0.36
AURKB Q96GD4 1/20 0.36
STK17B O94768 1/20 0.35
STK17A Q9UEE5 1/20 0.35
AAK1 Q2M2I8 1/20 0.33
CDK1 P06493 1/20 0.33

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
SCHEMBL13623071 0.96 SYK (0.46) SYKP2RX3ITKEGFRAURKB
SCHEMBL4340593 0.92 STK17B (0.41) SYKP2RX3EGFRAURKBSTK17B
SCHEMBL1024947 0.92 P2RX3 (0.37) SYKP2RX3ITKEGFRAURKB
SCHEMBL4341114 0.91 SYK (0.50) SYKP2RX3ITKEGFR
SCHEMBL13623074 0.89 P2RX3 (0.38) SYKP2RX3ITKEGFRAURKB
SCHEMBL1027538 0.88 SYK (0.41) SYKP2RX3ITKEGFRAURKB
SCHEMBL13622748 0.88 STK17B (0.43) SYKP2RX3EGFRAURKBSTK17B
SCHEMBL13623076 0.86 SYK (0.54) SYKP2RX3ITKEGFRCDK1
SCHEMBL13623063 0.84 SYK (0.55) SYKITKEGFRCDK1
SCHEMBL2523055 0.83 STK17B (0.44) P2RX3ITKEGFRSTK17BSTK17A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
EP-2274288-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS Incyte Corporation (US) 2011-01-19 EP disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
WO-2009132202-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-10-29 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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK SYK 46/4885P2RX3 3525/4885ITK 379/4885

“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.