SCHEMBL4348221

SCHEMBL4348221

O=C(O)Nc1ccnc(CCc2cccc(Nc3nc(Cl)ncc3Cl)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
EGFR P00533 6/20 0.40
BTK Q06187 4/20 0.40
CTSC P53634 1/20 0.38
JAK3 P52333 2/20 0.38
MET P08581 1/20 0.38
ALK Q9UM73 1/20 0.38
RHOA P61586 1/20 0.37
SYK P43405 1/20 0.37
JAK2 O60674 1/20 0.37
TYK2 P29597 1/20 0.37
STAT6 P42226 1/20 0.37

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
SCHEMBL1025701 0.90 ALDH1A1 (0.49) ALDH1A1KDM4EGAAEGFRBTK
SCHEMBL1025168 0.87 NR3C2 (0.47) ALDH1A1KDM4EGAAEGFRBTK
SCHEMBL13623027 0.86 SYK (0.44) ALDH1A1KDM4EGAAEGFRBTK
SCHEMBL1025950 0.85 KDM4E (0.41) ALDH1A1KDM4EGAAEGFRBTK
SCHEMBL1024973 0.85 CTSC (0.40) EGFRBTKCTSCJAK3RHOA
SCHEMBL1027584 0.84 MAPT (0.51) ALDH1A1GAAEGFRBTKJAK3
SCHEMBL13623028 0.83 BCL6 (0.42) ALDH1A1KDM4EGAAEGFRCTSC
SCHEMBL1025084 0.83 JAK3 (0.42) EGFRBTKCTSCJAK3RHOA
SCHEMBL4333056 0.83 EGFR (0.41) EGFRBTKCTSCJAK3MET
SCHEMBL1023949 0.83 ALDH1A1 (0.40) ALDH1A1KDM4EGAAEGFRBTK

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 3 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
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 ALDH1A1 2511/4885KDM4E 248/4885GAA 2377/4885

“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.