SCHEMBL9043157

SCHEMBL9043157

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

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
MMP2 P08253 1/20 0.31
ANPEP P15144 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
SCHEMBL9044368 0.82 MMP2 (0.36) CYP19A1SIGMAR1MMP2ANPEP
SCHEMBL7883453 0.81 SIGMAR1 (0.34) CYP19A1SIGMAR1MMP2ANPEP
SCHEMBL9043153 0.80 MMP2 (0.35) CYP19A1SIGMAR1MMP2ANPEP
SCHEMBL7807951 0.80 CYP19A1 (0.32) CYP19A1SIGMAR1MMP2ANPEP
SCHEMBL9374194 0.79 CYP19A1 (0.32) CYP19A1SIGMAR1MMP2ANPEP
SCHEMBL9374200 0.79 CYP19A1 (0.32) CYP19A1SIGMAR1MMP2ANPEP
SCHEMBL7805520 0.78 MMP2 (0.48) CYP19A1SIGMAR1MMP2ANPEP
SCHEMBL8832761 0.77 CYP19A1 (0.31) CYP19A1SIGMAR1MMP2ANPEP
SCHEMBL9213704 0.77 CYP19A1 (0.31) CYP19A1SIGMAR1MMP2ANPEP
SCHEMBL8834391 0.76 CYP19A1 (0.31) CYP19A1SIGMAR1MMP2ANPEP

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-0551993-B1 Pyrrolidine derivatives and process for preparing the same SUMITOMO PHARMA (JP) 1996-07-10 EP disclosed
US-5322952-A Pyrrolidine derivatives and process for preparing the same SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1994-06-21 US disclosed
EP-0551993-A1 Pyrrolidine derivatives and process for preparing the same SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1993-07-21 EP disclosed