SCHEMBL12796243

SCHEMBL12796243

[2H]C([2H])([2H])n1ccc2cc(Nc3cc(Cl)ccn3)nc(NC3CC3)c2c1=O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SYK P43405 17/20 0.50
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38
BRD4 O60885 1/20 0.35
ATAD2 Q6PL18 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
SCHEMBL1158494 0.93 SYK (0.55) SYKNOS1NOS2BRD4ATAD2
SCHEMBL1158342 0.89 SYK (0.51) SYKNOS1NOS2BRD4ATAD2
SCHEMBL12795849 0.89 SYK (0.62) SYKNOS1NOS2
SCHEMBL12795858 0.89 SYK (0.62) SYKNOS1NOS2
SCHEMBL1157693 0.89 SYK (0.62) SYKNOS1NOS2
SCHEMBL12796042 0.86 SYK (0.60) SYK
SCHEMBL12795847 0.86 SYK (0.69) SYKNOS1NOS2
SCHEMBL12797762 0.86 SYK (0.69) SYKNOS1NOS2
SCHEMBL12796370 0.86 SYK (0.44) SYK
SCHEMBL12796368 0.84 SYK (0.34) SYK

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053897-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS IRM LLC (BM) 2011-03-03 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-20110053897-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS SYK, BTK, LYN SYK 1/4885NOS1 737/4885NOS2 772/4885

“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.