SCHEMBL31455205

SCHEMBL31455205

CC(C)(C)OC(=O)N1CC(c2ccc(Nc3nc(-c4ccccc4)ccc3[N+](=O)[O-])cc2F)C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 1/20 0.38
ABCG2 Q9UNQ0 3/20 0.38
USP30 Q70CQ3 4/20 0.37
BRD4 O60885 2/20 0.36
JAK2 O60674 7/20 0.36
JAK3 P52333 6/20 0.36
PTK2 Q05397 5/20 0.36
JAK1 P23458 1/20 0.36
TP53 P04637 1/20 0.36
MKNK1 Q9BUB5 1/20 0.35
BACE1 P56817 1/20 0.35
BACE2 Q9Y5Z0 1/20 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
SCHEMBL31420326 0.87 NAMPT (0.40) PRKCQABCG2USP30JAK2JAK3
SCHEMBL31455264 0.85 USP30 (0.39) PRKCQUSP30JAK2JAK3
SCHEMBL31455102 0.82 NAMPT (0.45) PRKCQUSP30JAK2JAK3PTK2
SCHEMBL31455683 0.82 JAK2 (0.46) JAK2JAK3PTK2JAK1
SCHEMBL31455378 0.82 HPGDS (0.44) PRKCQUSP30JAK2JAK3PTK2
SCHEMBL31420375 0.80 NAMPT (0.51) JAK2JAK3PTK2JAK1
SCHEMBL31455277 0.80 PRKCQ (0.37) PRKCQUSP30TP53BACE1
SCHEMBL31455545 0.79 ABCG2 (0.41) ABCG2BRD4
SCHEMBL31455653 0.77 ABCG2 (0.39) ABCG2BRD4JAK2JAK1
SCHEMBL30802461 0.76 JAK2 (0.44) JAK2JAK3

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
WO-2025059577-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS FOR USE AS AKT1 INHIBITORS ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed
WO-2025059562-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS AND METHODS OF TREATING DISEASE USING SAME ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed