SCHEMBL28845008

SCHEMBL28845008

O=C(O)C1(C(=O)O)CC2CCN1CC2

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
BPTF Q12830 1/20 0.31
GRM2 Q14416 2/20 0.30
GRM5 P41594 1/20 0.30
GRM1 Q13255 1/20 0.30
THRB P10828 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL28148039 0.78 CYP3A4 (0.40) LMNACYP2C9
SCHEMBL28148038 0.73 CYP3A4 (0.42) HSD11B1L3MBTL1LMNATHRBCYP2C9
SCHEMBL1404045 0.68 HSD11B1 (0.30) HSD11B1L3MBTL1
SCHEMBL277859 0.67 HTT (0.32) HSD11B1L3MBTL1THRBCYP2C9
SCHEMBL16054051 0.67 EPHX1 (0.33) HSD11B1L3MBTL1
SCHEMBL3390481 0.63
SCHEMBL493467 0.63 HTT (0.36) HSD11B1L3MBTL1MEN1KMT2A
SCHEMBL18921038 0.62 HSD11B1 (0.35) HSD11B1L3MBTL1THRBCYP2C9
SCHEMBL21391723 0.62
SCHEMBL4961193 0.62 LMNA (0.35) SMN1; SMN2LMNATHRB

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-115368440-A Euphausia superba oligomeric composite peptide 山东鲁华海洋生物科技有限公司 2022-11-22 CN disclosed
CN-106928126-A A kind of amide derivatives and preparation method thereof and application pharmaceutically 四川海思科制药有限公司 2017-07-07 CN disclosed
CN-106699744-A Heterocyclic acylamide derivative and preparation method and pharmaceutical application thereof 四川海思科制药有限公司 2017-05-24 CN disclosed