SCHEMBL19229727

SCHEMBL19229727

C=CC(=O)N1CCCC[C@@H](C(C)C)C1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 16/20 0.38
TEAD1 P28347 2/20 0.38
JAK1 P23458 1/20 0.37
EGFR P00533 1/20 0.36
ITK Q08881 1/20 0.36
BTK Q06187 2/20 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
SCHEMBL19229728 1.00 JAK3 (0.38) JAK3TEAD1JAK1EGFRITK
SCHEMBL19229729 1.00 JAK3 (0.38) JAK3TEAD1JAK1EGFRITK
SCHEMBL1628865 0.95 JAK3 (0.41) JAK3TEAD1JAK1EGFRITK
SCHEMBL410336 0.95 JAK3 (0.41) JAK3TEAD1JAK1EGFRITK
SCHEMBL1628867 0.95 JAK3 (0.41) JAK3TEAD1JAK1EGFRITK
SCHEMBL14479237 0.88 TEAD1 (0.40) JAK3TEAD1BTK
SCHEMBL1629421 0.88 TEAD1 (0.40) JAK3TEAD1BTK
SCHEMBL1630022 0.88 TEAD1 (0.40) JAK3TEAD1BTK
SCHEMBL24021438 0.83 JAK3 (0.42) JAK3JAK1EGFRITKBTK
SCHEMBL19240691 0.83 JAK3 (0.45) JAK3JAK1EGFRITKBTK

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-20170233411-A1 THIAZOLYL-CONTAINING COMPOUNDS FOR TREATING PROLIFERATIVE DISEASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-08-17 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-20170233411-A1 THIAZOLYL-CONTAINING COMPOUNDS FOR TREATING PROLIFERATIVE DISEASES BTK, BCL9L, BCL9 JAK3 182/4885TEAD1 3282/4885JAK1 117/4885

“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.