SCHEMBL28566941

SCHEMBL28566941

CC(C)(C)OC(=O)N1C[C@H](OS(C)(=O)=O)CC1(COCc1ccccc1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.38
NR1H2 P55055 3/20 0.37
NR1H3 Q13133 3/20 0.37
TACR1 P25103 1/20 0.37
KLK7 P49862 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
GPR119 Q8TDV5 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
PPARA Q07869 1/20 0.34

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
SCHEMBL28563885 0.91 STS (0.39) STSNR1H2NR1H3TACR1KLK7
SCHEMBL28588244 0.86 PRMT5 (0.37) STSTACR1KLK7JAK2JAK1
SCHEMBL24999625 0.85 STS (0.37) STSNR1H2NR1H3TACR1KLK7
SCHEMBL28831739 0.83 TACR1 (0.39) STSTACR1KLK7JAK2JAK1
SCHEMBL24175977 0.83 TACR1 (0.41) STSTACR1KLK7JAK2JAK1
SCHEMBL8107411 0.81 NR1H2 (0.35) NR1H2NR1H3GPR119
SCHEMBL27376812 0.79 ABCB1 (0.40) STSKLK7JAK2JAK1GPR119
SCHEMBL27223326 0.79 ABCB1 (0.40) STSKLK7JAK2JAK1GPR119
SCHEMBL28638548 0.79 STS (0.43) STSNR1H2NR1H3JAK2JAK1
SCHEMBL24999952 0.78 TACR1 (0.35) STSTACR1KLK7L3MBTL1PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114805389-B Tricyclic dihydro-imidazo pyrimidinone derivatives, preparation method, pharmaceutical compositions and uses thereof 上海赛默罗生物科技有限公司 2023-08-29 CN disclosed
CN-114805389-A Tricyclic dihydroimidazopyrimidinone derivatives, preparation method, pharmaceutical composition and application thereof 上海赛默罗生物科技有限公司 2022-07-29 CN disclosed
CN-112778331-B Tricyclic dihydroimidazopyrimidinone derivatives, preparation method, pharmaceutical composition and application thereof 上海赛默罗生物科技有限公司 2022-07-05 CN disclosed
CN-112778331-A Tricyclic dihydroimidazopyrimidinone derivatives, preparation method, pharmaceutical composition and application thereof 上海赛默罗生物科技有限公司 2021-05-11 CN disclosed