SCHEMBL22079331

SCHEMBL22079331

COC(=O)CC1(C=O)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CNR2 P34972 1/20 0.40
EPHX2 P34913 1/20 0.39
TSHR P16473 2/20 0.39
ALOX15 P16050 1/20 0.39
ATM Q13315 1/20 0.39
EPHX1 P07099 1/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
HPGD P15428 1/20 0.37
ALDH1A1 P00352 1/20 0.36
PKM P14618 1/20 0.36
MMP2 P08253 1/20 0.36
MMP13 P45452 1/20 0.36
MMP14 P50281 1/20 0.36
ADAM17 P78536 1/20 0.36

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
SCHEMBL14297528 0.89 USP2 (0.44) USP2SMN1; SMN2EPHX2TSHRALOX15
SCHEMBL16987094 0.87 USP2 (0.45) USP2SMN1; SMN2EPHX2TSHRALOX15
SCHEMBL31088801 0.86 SMN1; SMN2 (0.40) USP2SMN1; SMN2EPHX2TSHRALOX15
SCHEMBL17065177 0.82 USP2 (0.46) USP2SMN1; SMN2EPHX2TSHRALOX15
SCHEMBL2799150 0.82 USP2 (0.43) USP2SMN1; SMN2EPHX2EPHX1DDB1
SCHEMBL23070802 0.81 USP2 (0.45) USP2SMN1; SMN2EPHX2TSHRALOX15
SCHEMBL2442944 0.81 USP2 (0.45) USP2SMN1; SMN2EPHX2TSHRALOX15
SCHEMBL414000 0.81 USP2 (0.45) USP2SMN1; SMN2EPHX2TSHRALOX15
SCHEMBL21388184 0.81 USP2 (0.45) USP2SMN1; SMN2EPHX2TSHRALOX15
SCHEMBL24752804 0.81 USP2 (0.45) USP2SMN1; SMN2CNR2EPHX2TSHR

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-111285875-B Heterocyclic compound, application thereof and pharmaceutical composition containing same 苏州信诺维医药科技股份有限公司 2023-02-03 CN disclosed
CN-111285875-A Heterocyclic compound, application thereof and pharmaceutical composition containing same 苏州信诺维医药科技有限公司 2020-06-16 CN disclosed
WO-2020114474-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME 苏州信诺维医药科技有限公司 2020-06-11 WO disclosed