SCHEMBL9687108

SCHEMBL9687108

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

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 1/20 0.33
DRD2 P14416 1/20 0.32
KDM4D Q6B0I6 2/20 0.31
MCHR1 Q99705 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
SCHEMBL9687809 0.83 MCHR1 (0.34) DRD2MCHR1
SCHEMBL9687111 0.74 DRD2 (0.40) DRD2
SCHEMBL9688424 0.67 POLB (0.40)
SCHEMBL23343275 0.64 DRD2 (0.36) DRD2
SCHEMBL9686535 0.64 AKR1C3 (0.43)
SCHEMBL31007108 0.63 AKR1C3 (0.42)
SCHEMBL29217933 0.63 AKR1C3 (0.42)
SCHEMBL5529736 0.63 NFKB1 (0.51) DRD2
SCHEMBL5529209 0.63 NFKB1 (0.51) DRD2
SCHEMBL5522770 0.63 NFKB1 (0.51) DRD2

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