SCHEMBL9567070

SCHEMBL9567070

C=CCOC(=O)N(C)C(=C)C[C@H]1C[C@H](S)CN1C(=O)OCC=C

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 1/20 0.34
SIGMAR1 Q99720 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
SCHEMBL9595912 0.85 ECE1 (0.33) ECE1
SCHEMBL9204827 0.79 SIGMAR1 (0.33) ECE1SIGMAR1
SCHEMBL7805556 0.77 ECE1 (0.34) ECE1SIGMAR1
SCHEMBL9596180 0.76 CYP19A1 (0.31) SIGMAR1
SCHEMBL9567069 0.76 CYP19A1 (0.31) SIGMAR1
SCHEMBL9595209 0.76 ECE1 (0.34) ECE1
SCHEMBL7800284 0.75
SCHEMBL8011538 0.74 CYP19A1 (0.33) SIGMAR1
SCHEMBL8865106 0.74 CYP19A1 (0.33) SIGMAR1
SCHEMBL9020433 0.73

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
WO-1993001192-A1 2-(2-SUBSTITUTED PYRROLIDINYLTHIO)CARBAPENEM DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-01-21 WO disclosed
EP-0522504-A1 2-(2-substituted pyrrolidinylthio)-carbapenem derivatives Banyu Pharmaceutical Co., Ltd. (JP) 1993-01-13 EP disclosed