SCHEMBL22799096

SCHEMBL22799096

CC1COC2(CCN(C(=O)OC(C)(C)C)CC2)C1=C=O

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ RECQL P46063 1/20 0.38
▸ HPGD P15428 1/20 0.36
▸ GPR119 Q8TDV5 5/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ EPHX1 P07099 1/20 0.35
▸ PTPN2 P17706 1/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ PTPN6 P29350 1/20 0.35
▸ DDB1 Q16531 1/20 0.35
▸ CRBN Q96SW2 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ KMT2A Q03164 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
SCHEMBL23002541 0.83 USP2 (0.44) USP2SMN1; SMN2MAPTKDM4ETHRB
SCHEMBL22799173 0.78 MAPT (0.42) USP2SMN1; SMN2MAPTKDM4ETHRB
SCHEMBL19379559 0.78 USP2 (0.41) USP2SMN1; SMN2MAPTKDM4ETHRB
SCHEMBL17760295 0.78 USP2 (0.41) USP2SMN1; SMN2MAPTKDM4ETHRB
SCHEMBL17725623 0.78 USP2 (0.41) USP2SMN1; SMN2MAPTKDM4ETHRB
SCHEMBL22798969 0.75 USP2 (0.41) USP2SMN1; SMN2MAPTKDM4ETHRB
SCHEMBL20487497 0.75 USP2 (0.39) USP2SMN1; SMN2MAPTKDM4ETHRB
SCHEMBL21710557 0.75 USP2 (0.39) USP2SMN1; SMN2MAPTKDM4ETHRB
SCHEMBL22798973 0.74 USP2 (0.43) USP2SMN1; SMN2MAPTRECQLHPGD
SCHEMBL22799174 0.74 USP2 (0.47) USP2SMN1; SMN2RECQLHPGDGPR119

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-115448923-B Pyrimidine-fused ring compound, preparation method and application thereof 上海青煜医药科技有限公司 2024-03-22 — — CN disclosed
CN-110156786-B Pyrimido-cyclic compounds, process for their preparation and their use 青煜医药研发(上海)有限公司 2022-06-03 — — CN disclosed
EP-3753941-A1 PYRIMIDINE-FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shanghai Blueray Biopharma Co., Ltd. (CN) 2020-12-23 — — EP disclosed
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