SCHEMBL28568005

SCHEMBL28568005

CC(C)(C)OC(=O)N1CCN(c2cc(F)c3c(c2Br)OCC(N)C3)CC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.39
BACE1 P56817 5/20 0.39
KCNH2 Q12809 2/20 0.39
DPP4 P27487 1/20 0.39
MAPT P10636 2/20 0.39
THRB P10828 2/20 0.39
KDM4E B2RXH2 1/20 0.39
KIT P10721 1/20 0.38
GPR119 Q8TDV5 3/20 0.38
SMARCA2 P51531 1/20 0.38
SMARCA4 P51532 1/20 0.38
PBRM1 Q86U86 1/20 0.38
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
PDK2 Q15119 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
SCHEMBL28568004 1.00 USP30 (0.39) USP30BACE1KCNH2DPP4MAPT
SCHEMBL21704066 0.86 GPR119 (0.40) KCNH2DPP4MAPTTHRBKDM4E
SCHEMBL21686014 0.85 MAPK1 (0.34) MAPTKDM4EALDH1A1
SCHEMBL20722741 0.85 MAPK1 (0.34) MAPTKDM4EALDH1A1
SCHEMBL21686015 0.85 MAPK1 (0.34) MAPTKDM4EALDH1A1
SCHEMBL30059886 0.80 MAPT (0.42) DPP4MAPTTHRBKDM4EKIT
SCHEMBL30061814 0.80 MAPT (0.42) DPP4MAPTTHRBKDM4EKIT
SCHEMBL21704014 0.80 MAPT (0.42) DPP4MAPTTHRBKDM4EKIT
SCHEMBL20732122 0.80 MAPT (0.42) DPP4MAPTTHRBKDM4EKIT
SCHEMBL28565689 0.78 BACE1 (0.47) BACE1MAPTALDH1A1

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
CN-112867712-B Carboxamide as ubiquitin-specific protease inhibitor 瓦洛早期发现股份有限公司 2024-07-16 CN disclosed
CN-112867712-A Carboxamides as ubiquitin-specific protease inhibitors 瓦洛早期发现股份有限公司 2021-05-28 CN disclosed