SCHEMBL6417138

SCHEMBL6417138

CN(C(=O)c1ccccc1)c1ccc2c(c1)nc(C(N)=O)n2CCc1cc[nH]c(=O)c1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITK Q08881 20/20 0.51
INSR P06213 9/20 0.51
TXK P42681 2/20 0.47

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
SCHEMBL6417144 0.90 ITK (0.50) ITKINSRTXK
SCHEMBL6413792 0.83 ITK (0.54) ITKINSRTXK
SCHEMBL6275057 0.82 ITK (0.54) ITKINSRTXK
SCHEMBL6420659 0.82 ITK (0.51) ITKINSRTXK
SCHEMBL6416912 0.81 ITK (0.72) ITKINSRTXK
SCHEMBL6413985 0.81 ITK (0.50) ITKINSRTXK
SCHEMBL6417136 0.81 ACHE (0.39)
SCHEMBL6272966 0.80 ITK (0.54) ITKINSRTXK
SCHEMBL6417114 0.80 ITK (0.59) ITKINSRTXK
SCHEMBL6416237 0.80 ITK (0.62) ITKINSRTXK

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-20050209284-A1 Tec kinase inhibitors BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-09-22 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-20050209284-A1 Tec kinase inhibitors TEC, ITK, TXK ITK 2/4885INSR 910/4885TXK 3/4885

“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.