SCHEMBL24615465

SCHEMBL24615465

CC1(C)OB(c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)OC1(C)C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 15/20 0.42
JAK2 O60674 15/20 0.42
JAK1 P23458 15/20 0.42
JAK3 P52333 5/20 0.37
IRAK4 Q9NWZ3 1/20 0.33
ROCK1 Q13464 1/20 0.32
FFAR1 O14842 1/20 0.31
KDR P35968 1/20 0.31
STAT1 P42224 1/20 0.31

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
SCHEMBL24615471 0.89 JAK1 (0.39) TYK2JAK2JAK1JAK3IRAK4
SCHEMBL24615488 0.85 JAK2 (0.40) TYK2JAK2JAK1JAK3
SCHEMBL29772733 0.82 JAK1 (0.42) JAK1FFAR1
SCHEMBL24615235 0.82 TYK2 (0.44) TYK2JAK2JAK1JAK3KDR
SCHEMBL24615373 0.81 TYK2 (0.44) TYK2JAK2JAK1JAK3KDR
SCHEMBL29772744 0.80 JAK1 (0.41) TYK2JAK2JAK1JAK3KDR
SCHEMBL29772730 0.80 JAK1 (0.41) TYK2JAK2JAK1JAK3KDR
SCHEMBL24615433 0.80 JAK2 (0.49) TYK2JAK2JAK1JAK3
SCHEMBL24615410 0.78 TYK2 (0.45) TYK2JAK2JAK1JAK3
SCHEMBL24615448 0.77 JAK1 (0.41) TYK2JAK2JAK1JAK3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4274832-A1 TYK2 INHIBITORS Biogen MA Inc. (US) 2023-11-15 EP disclosed
WO-2022150446-A1 TYK2 INHIBITORS BIOGEN MA INC. (US) 2022-07-14 WO disclosed
WO-2022150446-A1 TYK2 INHIBITORS BIOGEN MA INC. (US) 2022-07-14 WO disclosed