SCHEMBL2263804

SCHEMBL2263804

CC(C)(C)OC(=O)N[C@H]1CCCN(c2c(F)cnc3cnc(B4OC(C)(C)C(C)(C)O4)cc23)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 3/20 0.44
JAK3 P52333 2/20 0.44
MAP4K4 O95819 2/20 0.42
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
USP30 Q70CQ3 1/20 0.40
PDE10A Q9Y233 1/20 0.39
SYK P43405 1/20 0.39
RET P07949 2/20 0.38
AURKA O14965 3/20 0.38
PDPK1 O15530 3/20 0.38
AURKB Q96GD4 3/20 0.38
MET P08581 1/20 0.38
F10 P00742 1/20 0.37
EGFR P00533 1/20 0.37
LCK P06239 1/20 0.37
DPP4 P27487 1/20 0.36
NTRK1 P04629 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL2263800 1.00 BTK (0.44) BTKJAK3MAP4K4ALOX5APFEN1
SCHEMBL2201869 0.85 BTK (0.45) BTKJAK3MAP4K4USP30PDE10A
SCHEMBL2201866 0.85 BTK (0.45) BTKJAK3MAP4K4USP30PDE10A
SCHEMBL2205066 0.84 BTK (0.52) BTKJAK3MAP4K4ALOX5APFEN1
SCHEMBL2205071 0.84 BTK (0.52) BTKJAK3MAP4K4ALOX5APFEN1
SCHEMBL12367227 0.80 ADRB2 (0.37) JAK3
SCHEMBL31262639 0.74 BTK (0.53) BTKJAK3MAP4K4ALOX5APFEN1
SCHEMBL2205363 0.73 MAP4K4 (0.47) BTKJAK3MAP4K4USP30PDE10A
SCHEMBL2205365 0.73 MAP4K4 (0.47) BTKJAK3MAP4K4USP30PDE10A
SCHEMBL14689168 0.71 USP30 (0.45) BTKJAK3MAP4K4USP30PDE10A

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-8735424-B2 Bicyclic kinase inhibitors NOVARTIS AG (CH) 2014-05-27 US disclosed
US-8735424-B2 Bicyclic kinase inhibitors NOVARTIS AG (CH) 2014-05-27 US disclosed
US-20110195980-A1 Bicyclic Kinase Inhibitors NOVARTIS AG (CH) 2011-08-11 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-20110195980-A1 Bicyclic Kinase Inhibitors PIM1, PIM2, PIM3 BTK 73/4885JAK3 217/4885MAP4K4 115/4885

“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.