SCHEMBL1026445

SCHEMBL1026445

O=C(O)Nc1cccc(SCc2cccc(Nc3nc(Cl)ncc3Cl)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 4/20 0.42
BTK Q06187 4/20 0.41
MET P08581 2/20 0.41
ALK Q9UM73 2/20 0.41
EGFR P00533 7/20 0.40
MAPT P10636 2/20 0.40
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TTK P33981 1/20 0.39

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
SCHEMBL4333056 0.91 EGFR (0.41) JAK3BTKMETALKEGFR
SCHEMBL4364555 0.91 JAK3 (0.43) JAK3BTKEGFRMAPTJAK2
SCHEMBL1025084 0.87 JAK3 (0.42) JAK3BTKEGFRMAPTJAK2
SCHEMBL13623085 0.86 SYK (0.45) JAK3BTKMETALKEGFR
SCHEMBL13623083 0.85 BCL6 (0.44) JAK3METALKEGFRJAK2
SCHEMBL1025086 0.84 BCL6 (0.38) JAK3BTKMETALKEGFR
Trifluoroacetic Acid SCHEMBL1026827 0.84 CTSC (0.41) METALK
SCHEMBL4335022 0.84 BTK (0.42) JAK3BTKEGFR
SCHEMBL13670005 0.84 CTSC (0.37) JAK3EGFRJAK2JAK1
SCHEMBL4334815 0.84 EGFR (0.42) BTKMETALKEGFRMAPT

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 JAK3 4/4885BTK 20/4885MET 599/4885

“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.