SCHEMBL31455378

SCHEMBL31455378

CC(C)(C)OC(=O)N1CCCC(c2ccc(Nc3nc(-c4ccccc4)ccc3[N+](=O)[O-])cc2)C1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 2/20 0.44
USP30 Q70CQ3 5/20 0.42
PRMT5 O14744 2/20 0.42
NAMPT P43490 1/20 0.41
JAK3 P52333 3/20 0.40
BTK Q06187 2/20 0.40
LCK P06239 1/20 0.40
PRKCQ Q04759 1/20 0.40
ACKR3 P25106 1/20 0.40
JAK2 O60674 5/20 0.39
PTK2 Q05397 2/20 0.39
JAK1 P23458 3/20 0.39
GPR119 Q8TDV5 1/20 0.39

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
SCHEMBL31455102 0.96 NAMPT (0.45) HPGDSUSP30NAMPTJAK3BTK
SCHEMBL31420326 0.93 NAMPT (0.40) HPGDSUSP30NAMPTJAK3BTK
SCHEMBL31420375 0.91 NAMPT (0.51) NAMPTJAK3BTKLCKJAK2
SCHEMBL31455683 0.84 JAK2 (0.46) JAK3BTKLCKJAK2PTK2
SCHEMBL31455264 0.84 USP30 (0.39) HPGDSUSP30JAK3PRKCQJAK2
SCHEMBL31455205 0.82 PRKCQ (0.38) USP30JAK3PRKCQJAK2PTK2
SCHEMBL31455277 0.81 PRKCQ (0.37) HPGDSUSP30NAMPTPRKCQGPR119
SCHEMBL30802461 0.80 JAK2 (0.44) JAK3ACKR3JAK2
SCHEMBL27225984 0.80 JAK2 (0.44) JAK3ACKR3JAK2
SCHEMBL31455299 0.79 SLC34A1 (0.40) USP30NAMPTJAK3BTKLCK

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