SCHEMBL7540588

SCHEMBL7540588

C=CCOC(=O)N1CCC(OS(C)(=O)=O)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.42
PLG P00747 2/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
F2 P00734 1/20 0.37
GPR119 Q8TDV5 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
HTT P42858 1/20 0.34
GAA P10253 2/20 0.34
F13A1 P00488 2/20 0.33
TGM2 P21980 2/20 0.33
TGM1 P22735 2/20 0.33
LMNA P02545 2/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
NR1D1 P20393 1/20 0.33
TSHR P16473 1/20 0.33
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL31682843 1.00 F10 (0.42) F10PLGPRSS1PRSS2PRSS3
SCHEMBL13978434 1.00 F10 (0.42) F10PLGPRSS1PRSS2PRSS3
SCHEMBL6497279 0.92 F10 (0.40) F10PLGPRSS1PRSS2PRSS3
SCHEMBL31682777 0.89 F10 (0.35) F10PLGPRSS1PRSS2PRSS3
SCHEMBL23585416 0.84 GAA (0.47) L3MBTL1HTTGAALMNATSHR
SCHEMBL17235878 0.80 BTK (0.38)
SCHEMBL9052957 0.80 GPR119 (0.41) GPR119L3MBTL1HTTGAALMNA
SCHEMBL2360585 0.78 SMN1; SMN2 (0.47) GPR119L3MBTL1HTTGAALMNA
SCHEMBL31131213 0.78 SMN1; SMN2 (0.47) GPR119L3MBTL1HTTGAALMNA
SCHEMBL8865061 0.78 GPR119 (0.38) F10PLGPRSS1PRSS2PRSS3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023235456-A1 PENEM ANTIBACTERIALS AGAINST MYCOBACTERIAL PATHOGENS AND D,D- AND L,D TRANSPEPTIDASES THE JOHNS HOPKINS UNIVERSITY (US) 2023-12-07 WO disclosed
EP-0928787-B1 Process for the preparation of 3-amino-pyrrolidine derivatives BASILEA PHARMACEUTICA AG (CH) 2002-06-05 EP disclosed
EP-1138672-A1 Process for the preparation of 3-amino-pyrrolidine derivatives Basilea Pharmaceutica AG (CH) 2001-10-04 EP disclosed
US-5977381-A Process for making 3-amino-pyrolidine derivatives HOFFMANN-LA ROCHE INC. (US) 1999-11-02 US disclosed
EP-0928787-A1 Process for the preparation of 3-amino-pyrrolidine derivatives F. Hoffmann-La Roche AG (CH) 1999-07-14 EP disclosed