SCHEMBL12929344

SCHEMBL12929344

CN1C=Cc2cc(-c3cnc(N)nc3)nc(Nc3cccc(OCCN4CCOCC4)c3)c2C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.49
SRC P12931 2/20 0.46
EGFR P00533 4/20 0.46
BTK Q06187 1/20 0.46
AIMP2 Q13155 2/20 0.45
ACHE P22303 2/20 0.43
BCHE P06276 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
ITK Q08881 2/20 0.42
PIK3CA P42336 2/20 0.41
PRKCQ Q04759 2/20 0.41
PIK3CD O00329 1/20 0.40
PIK3CB P42338 1/20 0.40
MTOR P42345 1/20 0.40
PIK3CG P48736 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
MAPK14 Q16539 1/20 0.39
MET P08581 1/20 0.39
KDR P35968 1/20 0.39

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
SCHEMBL3360194 0.82 SRC (0.46) SYKSRCEGFRBTKAIMP2
SCHEMBL1049539 0.78 ZAP70 (0.59) SYKSRCEGFRBTKAIMP2
SCHEMBL1045575 0.77 ZAP70 (0.52) SYKSRCEGFRBTKAIMP2
SCHEMBL27806163 0.76 SRC (0.43) SYKSRCEGFRBTKITK
SCHEMBL3362294 0.74 BCHE (0.45) SYKSRCEGFRBTKACHE
SCHEMBL3359769 0.73 SYK (0.43) SYKSRCEGFRBTKAIMP2
SCHEMBL14578174 0.72 EPHX2 (0.61) SYKSRC
SCHEMBL1043309 0.71 ZAP70 (0.54) SYKSRCEGFRBTKAIMP2
SCHEMBL3393473 0.71 SYK (0.46) SYKSRCEGFRBTKAIMP2
SCHEMBL27826677 0.71 SYK (0.43) SYKBTKPIK3CAPIK3CDPIK3CB

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-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 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-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FYN, SYK, RET SYK 2/4885SRC 31/4885EGFR 237/4885

“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.