SCHEMBL22474744

SCHEMBL22474744

C=CC(=O)N1CCCCC(N)C1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 11/20 0.39
BTK Q06187 7/20 0.39
EGFR P00533 3/20 0.39
JAK1 P23458 2/20 0.39
JAK2 O60674 2/20 0.38

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
SCHEMBL13067829 0.95 JAK3 (0.42) JAK3BTKEGFRJAK1JAK2
SCHEMBL16123470 0.95 JAK3 (0.42) JAK3BTKEGFRJAK1JAK2
SCHEMBL16123340 0.95 JAK3 (0.42) JAK3BTKEGFRJAK1JAK2
SCHEMBL17833391 0.87 JAK3 (0.40) JAK3BTKJAK1
SCHEMBL17833394 0.87 JAK3 (0.40) JAK3BTKJAK1
SCHEMBL17833396 0.87 JAK3 (0.40) JAK3BTKJAK1
SCHEMBL23866200 0.80 TEAD1 (0.38) JAK3BTKEGFRJAK1JAK2
SCHEMBL19240725 0.79 ALDH1A1 (0.49) JAK3BTK
SCHEMBL19240724 0.79 ALDH1A1 (0.49) JAK3BTK
SCHEMBL19240726 0.79 ALDH1A1 (0.49) JAK3BTK

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
EP-3715346-A1 THIAZOLYL-CONTAINING COMPOUNDS FOR TREATING PROLIFERATIVE DISEASES Dana-Farber Cancer Institute (US) 2020-09-30 EP disclosed