SCHEMBL8833282

SCHEMBL8833282

C=CCOC(=O)N1C[C@H](OS(C)(=O)=O)C[C@H]1CCn1ccnc1CO

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL8832796 0.87
SCHEMBL8833308 0.87 ALDH1A1 (0.31) SIGMAR1
SCHEMBL9220610 0.85 SIGMAR1 (0.33) SIGMAR1
SCHEMBL8833376 0.85 SIGMAR1 (0.33) SIGMAR1
SCHEMBL8832700 0.82 SIGMAR1 (0.30) SIGMAR1
SCHEMBL9031817 0.82 NPSR1 (0.33)
SCHEMBL8832794 0.81 SIGMAR1 (0.33) SIGMAR1
SCHEMBL8832804 0.81
SCHEMBL8834306 0.80 SIGMAR1 (0.30) SIGMAR1
SCHEMBL8833642 0.80 CYP19A1 (0.31) SIGMAR1

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
US-5608056-A Substituted 3-pyrrolidinylthio-carbapenems as antimicrobial agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-04 US disclosed
WO-1993021186-A1 SUBSTITUTED 3-PYRROLIDINYLTHIO-CARBAPENEMS AS ANTIMICROBIAL AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-10-28 WO disclosed