SCHEMBL28638596

SCHEMBL28638596

CCOC(=O)c1nnc(N2CCOCC2)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGA O60502 2/20 0.52
PIK3CA P42336 2/20 0.48
PIK3CD O00329 1/20 0.46
PIK3CB P42338 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 7/20 0.45
ALDH1A1 P00352 6/20 0.45
MAPT P10636 3/20 0.45
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HPGD P15428 3/20 0.44
HSD17B10 Q99714 3/20 0.44
TSHR P16473 2/20 0.44
GLA P06280 1/20 0.44
MAPK1 P28482 1/20 0.44
HRH3 Q9Y5N1 1/20 0.43
AKT1 P31749 1/20 0.42
RXFP1 Q9HBX9 3/20 0.42
LMNA P02545 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL25417081 0.85 OGA (0.52) OGAL3MBTL1KDM4EALDH1A1MAPT
SCHEMBL15586978 0.84 OGA (0.54) OGAALDH1A1RXFP1
SCHEMBL20757351 0.83 OGA (0.50) OGAL3MBTL1KDM4EALDH1A1MAPT
SCHEMBL22556802 0.80 OGA (0.47) OGAALDH1A1MAPTGAASMN1; SMN2
SCHEMBL626980 0.79 PIK3CA (0.54) PIK3CAPIK3CDPIK3CBL3MBTL1KDM4E
SCHEMBL31704862 0.78 OGA (0.42) OGAPIK3CAL3MBTL1KDM4EALDH1A1
SCHEMBL625865 0.78 PIK3CA (0.68) PIK3CAPIK3CDPIK3CBL3MBTL1KDM4E
SCHEMBL30908402 0.77 OGA (0.55) OGAPIK3CAPIK3CDPIK3CBL3MBTL1
SCHEMBL24183656 0.77 HRH3 (0.52) MAPK1HRH3
SCHEMBL626001 0.77 PIK3CA (0.52) PIK3CAPIK3CDPIK3CBL3MBTL1KDM4E

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-113527281-B Heterocyclic compounds, process for their preparation and their use 昆山彭济凯丰生物科技有限公司 2023-12-22 CN disclosed
CN-113527281-A Heterocyclic compounds, their preparation and use 昆山彭济凯丰生物科技有限公司 2021-10-22 CN disclosed