SCHEMBL9687809

SCHEMBL9687809

CCC(c1ccc(O[Si](C)(C)C(C)(C)C)c(O[Si](C)(C)C(C)(C)C)c1)N1CCC(O)C1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.32
DRD2 P14416 1/20 0.32
HSD11B1 P28845 3/20 0.31
ALOX15 P16050 1/20 0.31
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 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
SCHEMBL9687108 0.83 SMPD3 (0.33) MCHR1DRD2
SCHEMBL9688424 0.76 POLB (0.40) PDE4B
SCHEMBL9687813 0.70 ABCB1 (0.42) DRD2
SCHEMBL9688429 0.70 OPRD1 (0.40) L3MBTL1DRD2
SCHEMBL23343275 0.69 DRD2 (0.36) DRD2
SCHEMBL5522770 0.68 NFKB1 (0.51) L3MBTL1DRD2ALOX15
SCHEMBL5529209 0.68 NFKB1 (0.51) L3MBTL1DRD2ALOX15
SCHEMBL5529736 0.68 NFKB1 (0.51) L3MBTL1DRD2ALOX15
SCHEMBL9686535 0.67 AKR1C3 (0.43)
SCHEMBL15004196 0.66 DRD2 (0.47) L3MBTL1DRD2PDE4APDE4BPDE4C

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0472062-A1 Beta-lactam compounds, and their production and use SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1992-02-26 EP disclosed