SCHEMBL9031817

SCHEMBL9031817

C=CCOC(=O)N1C[C@H](OS(C)(=O)=O)C[C@H]1CCn1ccnc1N1C(=O)c2ccccc2C1=O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.33
CYP19A1 P11511 1/20 0.31

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
SCHEMBL8833282 0.82 SIGMAR1 (0.32)
SCHEMBL8833308 0.81 ALDH1A1 (0.31) NPSR1
SCHEMBL7811591 0.80 NPSR1 (0.45) NPSR1CYP19A1
SCHEMBL8832726 0.77 LMNA (0.36) CYP19A1
SCHEMBL9210982 0.77 LMNA (0.36) CYP19A1
SCHEMBL8832796 0.77
SCHEMBL8833376 0.77 SIGMAR1 (0.33) CYP19A1
SCHEMBL9220610 0.77 SIGMAR1 (0.33) CYP19A1
SCHEMBL8832671 0.76 CYP19A1 (0.31) CYP19A1
SCHEMBL8832804 0.75

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
EP-0722447-A1 3-PYRROLIDINYLTHIO-CARBAPENEM DERIVATIVES AND THEIR ANTIMICROBAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-07-24 EP disclosed
WO-1995010520-A1 3-PYRROLIDINYLTHIO-CARBAPENEM DERIVATIVES AND THEIR ANTIMICROBAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-04-20 WO disclosed