SCHEMBL13623228

SCHEMBL13623228

CNC1CCN(c2ccc(Nc3nc(Cl)ncc3Cl)cc2CCc2cccc(NC(=O)OC(C)(C)C)c2)C1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 5/20 0.39
EGFR P00533 3/20 0.39
NTRK1 P04629 1/20 0.38
NTRK3 Q16288 1/20 0.38
NTRK2 Q16620 1/20 0.38
ALK Q9UM73 2/20 0.37
MET P08581 1/20 0.37
USP28 Q96RU2 2/20 0.37
USP25 Q9UHP3 2/20 0.37
SUV39H2 Q9H5I1 1/20 0.36
SYK P43405 1/20 0.36
F10 P00742 1/20 0.36
NPY2R P49146 1/20 0.35
STK17B O94768 1/20 0.35
STK17A Q9UEE5 1/20 0.35

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
SCHEMBL4365340 0.93 JAK3 (0.39) JAK3EGFRALKSUV39H2SYK
SCHEMBL13623218 0.88 JAK3 (0.51) JAK3EGFR
SCHEMBL13623215 0.87 JAK3 (0.48) JAK3EGFRALK
SCHEMBL1083564 0.85 ALK (0.36) JAK3EGFRALKMETSYK
SCHEMBL13623227 0.83 USP30 (0.41) USP28USP25F10NPY2R
SCHEMBL1025654 0.82 EGFR (0.42) JAK3EGFRALKMETSYK
SCHEMBL13622745 0.82 SYK (0.43) JAK3EGFRMETSYKSTK17B
SCHEMBL1027969 0.80 EGFR (0.43) JAK3EGFRMETSYKSTK17B
SCHEMBL1025626 0.80 SYK (0.42) JAK3EGFRMETSYKSTK17B
SCHEMBL13623059 0.78 STK17B (0.46) EGFRMETSYKSTK17BSTK17A

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 2 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-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 JAK3 4/4885EGFR 180/4885NTRK1 1080/4885

“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.