SCHEMBL23678568

SCHEMBL23678568

CCC(C(=O)Nc1nccc2c(-c3nc(Nc4cccc(SC)c4F)ncc3F)c[nH]c12)N1CCN(C)CC1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 16/20 0.70
▸ JAK2 O60674 12/20 0.70
▸ TYK2 P29597 1/20 0.61

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
SCHEMBL21870715 0.94 JAK2 (0.70) JAK1JAK2
SCHEMBL21870770 0.90 JAK1 (0.88) JAK1JAK2TYK2
SCHEMBL23678576 0.87 JAK2 (0.61) JAK1JAK2
SCHEMBL25959622 0.86 JAK1 (0.81) JAK1JAK2TYK2
SCHEMBL23678678 0.84 JAK1 (0.61) JAK1JAK2
SCHEMBL21871381 0.84 JAK1 (0.88) JAK1JAK2
SCHEMBL21870787 0.84 JAK1 (0.88) JAK1JAK2
SCHEMBL21870714 0.84 JAK1 (0.88) JAK1JAK2
SCHEMBL21870760 0.84 JAK2 (0.79) JAK1JAK2
SCHEMBL21870717 0.84 JAK2 (0.75) JAK1JAK2

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-3854793-A1 AROMATIC HETEROCYCLIC COMPOUND WITH KINASE INHIBITORY ACTIVITY Shanghai Ennovabio Pharmaceuticals Co., Ltd. (CN) 2021-07-28 — — EP disclosed
Send feedback