SCHEMBL28595178

SCHEMBL28595178

COC(=O)N1CCC(C(=O)OC(C)(C)C)C1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.51
HRH3 Q9Y5N1 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.46
RECQL P46063 1/20 0.46
EPHX1 P07099 1/20 0.46
PTPN2 P17706 1/20 0.45
PTPN1 P18031 1/20 0.45
PTPN6 P29350 1/20 0.45
STS P08842 5/20 0.44
ALDH1A1 P00352 3/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.42
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41

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
SCHEMBL8182758 1.00 HPGD (0.51) HPGDHRH3SMN1; SMN2RECQLEPHX1
SCHEMBL30885566 0.90 HPGD (0.62) HPGDHRH3SMN1; SMN2RECQLEPHX1
SCHEMBL1973022 0.87 HPGD (0.59) HPGDSMN1; SMN2RECQLEPHX1PTPN2
SCHEMBL1119307 0.87 HPGD (0.59) HPGDSMN1; SMN2RECQLEPHX1PTPN2
SCHEMBL1968331 0.87 HPGD (0.59) HPGDSMN1; SMN2RECQLEPHX1PTPN2
SCHEMBL9675197 0.84 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1TSHR
SCHEMBL4493181 0.83 HRH3 (0.54) HPGDHRH3SMN1; SMN2RECQLEPHX1
SCHEMBL4499465 0.83 HRH3 (0.54) HPGDHRH3SMN1; SMN2RECQLEPHX1
SCHEMBL750380 0.83 HRH3 (0.54) HPGDHRH3SMN1; SMN2RECQLEPHX1
SCHEMBL10774942 0.82 HRH3 (0.52) HPGDHRH3SMN1; SMN2RECQLEPHX1

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-108602823-B Spiro-condensed pyrrolidine derivatives as Deubiquitinase (DUB) inhibitors 特殊治疗有限公司 2022-04-01 CN disclosed
CN-108884068-B 1-cyano-pyrrolidine derivatives as DUB inhibitors 特殊治疗有限公司 2021-02-26 CN disclosed