SCHEMBL22720242

SCHEMBL22720242

CC1C=CCC12CCN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ GPR119 Q8TDV5 3/20 0.42
▸ HPGD P15428 1/20 0.40
▸ EPHX2 P34913 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ NAMPT P43490 5/20 0.39
▸ RECQL P46063 1/20 0.39
▸ EPHX1 P07099 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ PTPN2 P17706 1/20 0.39
▸ PTPN1 P18031 1/20 0.39
▸ PTPN6 P29350 1/20 0.39

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
SCHEMBL20337418 0.86 USP2 (0.43) USP2SMN1; SMN2GPR119HPGDEPHX2
SCHEMBL31184198 0.86 USP2 (0.43) USP2SMN1; SMN2GPR119HPGDEPHX2
SCHEMBL8217780 0.79 USP2 (0.50) USP2SMN1; SMN2GPR119HPGDEPHX2
SCHEMBL16984146 0.79 USP2 (0.50) USP2SMN1; SMN2GPR119HPGDEPHX2
SCHEMBL30577865 0.76 GPR119 (0.38) USP2SMN1; SMN2GPR119HPGDEPHX2
SCHEMBL24170473 0.76 HPGD (0.48) USP2SMN1; SMN2GPR119HPGDEPHX2
SCHEMBL30842433 0.75 USP2 (0.50) USP2SMN1; SMN2GPR119HPGDEPHX2
SCHEMBL1344048 0.75 USP2 (0.50) USP2SMN1; SMN2GPR119HPGDEPHX2
SCHEMBL22799171 0.75 HPGD (0.47) USP2SMN1; SMN2GPR119HPGDEPHX2
SCHEMBL21807018 0.74 USP2 (0.49) USP2SMN1; SMN2GPR119HPGDEPHX2

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
EP-3753941-A1 PYRIMIDINE-FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shanghai Blueray Biopharma Co., Ltd. (CN) 2020-12-23 — — EP disclosed
WO-2020239123-A1 AROMATIC HETEROCYCLIC DERIVATIVE MODULATOR AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2020-12-03 — — WO disclosed
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