SCHEMBL13622933

SCHEMBL13622933

CN(Cc1ccc2cc1CCc1cncc(c1)Nc1ncc(Cl)c(n1)N2)C(=O)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 8/20 0.44
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
JAK3 P52333 1/20 0.40
BIRC5 O15392 1/20 0.39
FNTA P49354 2/20 0.36
FNTB P49356 2/20 0.36
STS P08842 1/20 0.35
CCNT1 O60563 1/20 0.35
GPR119 Q8TDV5 2/20 0.33
PTPRB P23467 1/20 0.33
PTPN11 Q06124 1/20 0.33
USP30 Q70CQ3 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 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
Trifluoroacetic Acid SCHEMBL1075987 0.96 ALK (0.41) ALKJAK2JAK1TYK2JAK3
SCHEMBL13622945 0.90 ALK (0.44) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4353442 0.88 ALK (0.42) ALKJAK2JAK1TYK2JAK3
SCHEMBL13622936 0.87 JAK2 (0.45) ALKJAK2JAK1TYK2JAK3
Hydrochloric Acid SCHEMBL1075192 0.86 JAK2 (0.44) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4362730 0.86 ALK (0.41) ALKJAK2JAK1TYK2JAK3
SCHEMBL1075298 0.86 ALK (0.46) ALKJAK2JAK1TYK2JAK3
SCHEMBL1075634 0.86 ALK (0.42) ALKJAK2JAK1TYK2JAK3
SCHEMBL13622931 0.85 ALK (0.47) ALKJAK2JAK1TYK2JAK3
SCHEMBL1075325 0.85 ALK (0.40) ALKJAK2JAK1TYK2JAK3

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
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 3/4885JAK2 1/4885JAK1 2/4885

“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.