SCHEMBL6274629

SCHEMBL6274629

CC(NCc1ccc2c(c1)nc(C(N)=O)n2CC(C)(C)O)C(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ITK Q08881 16/20 0.55
INSR P06213 8/20 0.55
TEC P42680 4/20 0.40
TXK P42681 3/20 0.39
BTK Q06187 2/20 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
SCHEMBL6420438 1.00 ITK (0.55) ITKINSRTECTXKBTK
SCHEMBL6420992 1.00 ITK (0.55) ITKINSRTECTXKBTK
SCHEMBL6420998 0.85 ITK (0.52) ITKINSRTECTXKBTK
SCHEMBL6420442 0.85 ITK (0.52) ITKINSRTECTXKBTK
SCHEMBL6274631 0.85 ITK (0.52) ITKINSRTECTXKBTK
SCHEMBL6421019 0.81 ITK (0.56) ITKINSR
SCHEMBL6273767 0.80 ITK (0.42) ITKINSR
SCHEMBL6420350 0.80 ITK (0.50) ITKINSR
SCHEMBL6273963 0.78 ITK (0.49) ITKINSR
SCHEMBL6418924 0.78 ITK (0.46) ITKINSR

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 2 patents. 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
WO-2005079791-A1 THIOPHENE -2- CARBOXYLIC ACID - (1H - BENZIMIDAZOL - 2 YL) - AMIDE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE TEC KINASE ITK (INTERLEUKIN -2- INDUCIBLE T CELL KINASE) FOR THE TREATMENT OF INFLAMMATION, IMMUNOLOGICAL AND ALLERGIC DISORDERS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-09-01 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-20050209284-A1 Tec kinase inhibitors TEC, ITK, TXK ITK 2/4885INSR 910/4885TEC 1/4885

“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.