SCHEMBL28876540

SCHEMBL28876540

CC(C)(C)OC(=O)N1CCC(Nc2ncccc2N)C1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 2/20 0.55
USP30 Q70CQ3 5/20 0.52
PIK3CD O00329 1/20 0.51
JAK2 O60674 2/20 0.48
JAK3 P52333 2/20 0.48
GPR119 Q8TDV5 2/20 0.48
CCNA2 P20248 1/20 0.47
CDK2 P24941 1/20 0.47
ALDH1A1 P00352 2/20 0.47
POLB P06746 1/20 0.47
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 2/20 0.46
HSD11B1 P28845 2/20 0.46
CYP2D6 P10635 1/20 0.46
NPC1 O15118 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL30085275 1.00 BTK (0.55) BTKUSP30PIK3CDJAK2JAK3
SCHEMBL29124440 1.00 BTK (0.55) BTKUSP30PIK3CDJAK2JAK3
SCHEMBL31170988 1.00 BTK (0.55) BTKUSP30PIK3CDJAK2JAK3
SCHEMBL28876539 1.00 BTK (0.55) BTKUSP30PIK3CDJAK2JAK3
SCHEMBL30594359 0.93 ALDH1A1 (0.54) BTKUSP30JAK2JAK3GPR119
SCHEMBL2248990 0.93 ALDH1A1 (0.54) BTKUSP30JAK2JAK3GPR119
SCHEMBL31170960 0.91 POLB (0.47) BTKUSP30PIK3CDGPR119CCNA2
SCHEMBL21811050 0.91 POLB (0.47) BTKUSP30PIK3CDGPR119CCNA2
SCHEMBL30721802 0.87 USP30 (0.52) BTKUSP30GPR119CCNA2CDK2
SCHEMBL29151442 0.87 USP30 (0.52) BTKUSP30GPR119CCNA2CDK2

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
CN-112689637-B Imidazopyridone compounds 橘生药品工业株式会社 2023-11-10 CN disclosed
CN-115279761-A Crystals of imidazopyridinone compound or salt thereof 橘生药品工业株式会社 2022-11-01 CN disclosed
CN-112689637-A Imidazopyridinone compounds 橘生药品工业株式会社 2021-04-20 CN disclosed