SCHEMBL1075352

SCHEMBL1075352

Cc1ncoc1C(=O)Nc1ccc2cc1CCc1cccc(c1)Nc1ncc(Cl)c(n1)N2

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 10/20 0.56
ALDH1A1 P00352 3/20 0.46
JAK2 O60674 10/20 0.43
JAK1 P23458 10/20 0.43
JAK3 P52333 10/20 0.43
TYK2 P29597 9/20 0.43
LMNA P02545 2/20 0.41
HSD17B10 Q99714 2/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 1/20 0.41
STK4 Q13043 1/20 0.41
STK3 Q13188 1/20 0.41
STK26 Q9P289 1/20 0.41
STK24 Q9Y6E0 1/20 0.41

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
Trifluoroacetic Acid SCHEMBL4364619 0.95 ALK (0.51) ALKALDH1A1JAK2JAK1JAK3
SCHEMBL4363767 0.87 ALK (0.49) ALKALDH1A1JAK2JAK1JAK3
SCHEMBL4360159 0.86 ALK (0.58) ALKJAK2JAK1JAK3TYK2
SCHEMBL4353324 0.85 ALK (0.56) ALKJAK2JAK1JAK3TYK2
SCHEMBL1076087 0.85 ALK (0.53) ALKJAK2JAK1JAK3TYK2
SCHEMBL4366625 0.85 ALK (0.58) ALKJAK2JAK1JAK3TYK2
SCHEMBL4356306 0.84 ALK (0.62) ALKJAK2JAK1JAK3TYK2
SCHEMBL1075955 0.84 ALK (0.56) ALKJAK2JAK1JAK3TYK2
SCHEMBL4360741 0.84 ALK (0.56) ALKJAK2JAK1JAK3TYK2
SCHEMBL4360045 0.84 ALK (0.54) ALKALDH1A1JAK2JAK1JAK3

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
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US claimed
EP-2274288-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS Incyte Corporation (US) 2011-01-19 EP claimed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US claimed
WO-2009132202-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-10-29 WO claimed
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK ALK 3/4885ALDH1A1 2511/4885JAK2 1/4885

“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.