SCHEMBL9567182

SCHEMBL9567182

C=C(CNC)C[C@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.33
NR1H2 P55055 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL9567146 0.84 NR1H2 (0.33) ABCB1NR1H2TSHR
SCHEMBL30511021 0.84 ABCB1 (0.39) ABCB1NR1H2TSHR
SCHEMBL9596310 0.83 ABCB1 (0.33) ABCB1NR1H2
SCHEMBL12431668 0.81 NR1H2 (0.37) ABCB1NR1H2
SCHEMBL9595122 0.81 ABCB1 (0.34) ABCB1NR1H2
SCHEMBL8113817 0.81 NR1H2 (0.36) ABCB1NR1H2
SCHEMBL20312947 0.81 NR1H2 (0.42) ABCB1NR1H2
SCHEMBL21286125 0.81 NR1H2 (0.42) ABCB1NR1H2
SCHEMBL1372634 0.81 NR1H2 (0.42) ABCB1NR1H2
SCHEMBL139880 0.81 NR1H2 (0.42) ABCB1NR1H2

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