SCHEMBL13623018

SCHEMBL13623018

CC(C)(C)OC(=O)Nc1cccc(NS(=O)(=O)Cc2cccc(Nc3nc(Cl)ncc3Cl)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.48
MET P08581 7/20 0.45
ALK Q9UM73 6/20 0.45
STK17B O94768 1/20 0.43
STK17A Q9UEE5 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
BTK Q06187 4/20 0.42
JAK3 P52333 1/20 0.41
BRD4 O60885 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
EGFR P00533 2/20 0.41
AURKA O14965 1/20 0.40
RPS6KB1 P23443 1/20 0.40
ITK Q08881 1/20 0.40

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
SCHEMBL4180112 0.87 SYK (0.57) SYKMETALKSTK17BSTK17A
SCHEMBL4334678 0.86 MET (0.47) METALKNPC1ALDH1A1BTK
SCHEMBL13623023 0.86 MET (0.49) SYKMETALKSTK17BSTK17A
SCHEMBL13623118 0.86 AURKA (0.50) SYKMETSTK17BSTK17ABTK
SCHEMBL13623131 0.86 SYK (0.50) SYKMETSTK17BSTK17ABTK
SCHEMBL13623014 0.85 BTK (0.49) SYKMETALKSTK17BSTK17A
SCHEMBL13623129 0.85 SYK (0.47) SYKMETSTK17BSTK17ABTK
SCHEMBL13623203 0.84 MET (0.48) SYKMETALKSTK17BSTK17A
SCHEMBL1025373 0.83 STK17B (0.52) SYKMETSTK17BSTK17ABTK
SCHEMBL13623196 0.82 SYK (0.45) SYKMETSTK17BSTK17ABTK

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 SYK 46/4885MET 599/4885ALK 3/4885

“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.