SCHEMBL7548408

SCHEMBL7548408

CC(CCOS(C)(=O)=O)(OS(C)(=O)=O)OS(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.48
TSHR P16473 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
MMP9 P14780 1/20 0.48
ALOX15 P16050 1/20 0.48

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
SCHEMBL2058172 0.82 USP2 (0.48) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL3595211 0.78 USP2 (0.55) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL19257180 0.75 KDM4E (0.41) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL9111200 0.74 USP2 (0.50) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL2485099 0.74 USP2 (0.50) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL3369383 0.74 ALDH1A1 (0.50) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL783198 0.74 USP2 (0.56) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL6497418 0.73 TSHR (0.48) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL3370980 0.71 USP2 (0.52) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL18864591 0.71 USP2 (0.52) USP2TSHRKDM4EALDH1A1LMNA

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
EP-0928787-B1 Process for the preparation of 3-amino-pyrrolidine derivatives BASILEA PHARMACEUTICA AG (CH) 2002-06-05 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