SCHEMBL29022352

SCHEMBL29022352

CC(C)(C)OC(=O)N1CCOCC1c1nsc(=O)[nH]1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RECQL P46063 1/20 0.38
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MALT1 Q9UDY8 1/20 0.35
EPHX2 P34913 1/20 0.33
TSHR P16473 1/20 0.33
ATM Q13315 2/20 0.32
PIK3R1 P27986 2/20 0.31
PIK3CA P42336 2/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL29022350 1.00 USP2 (0.38) USP2SMN1; SMN2RECQLALDH1A1MEN1
SCHEMBL29022267 0.81 USP2 (0.39) USP2SMN1; SMN2RECQLALDH1A1MEN1
SCHEMBL29022271 0.81 USP2 (0.39) USP2SMN1; SMN2RECQLALDH1A1MEN1
SCHEMBL29022331 0.77 USP2 (0.40) USP2SMN1; SMN2RECQLALDH1A1MEN1
SCHEMBL29022329 0.77 USP2 (0.40) USP2SMN1; SMN2RECQLALDH1A1MEN1
SCHEMBL29372581 0.74 KDM4E (0.47) USP2SMN1; SMN2
SCHEMBL28502842 0.74 KDM4E (0.47) USP2SMN1; SMN2
SCHEMBL19013771 0.74 GAA (0.40) USP2SMN1; SMN2ALDH1A1L3MBTL1MALT1
SCHEMBL29022283 0.74 ALDH1A1 (0.40) USP2SMN1; SMN2RECQLALDH1A1MEN1
SCHEMBL29022338 0.74 USP2 (0.39) USP2SMN1; SMN2RECQLALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107793409-B Dihydropyrimidine compound and application thereof in medicine 广东东阳光药业有限公司 2022-09-27 CN disclosed