SCHEMBL5196630

SCHEMBL5196630

COC(=O)C1CC(CCCO[Si](C)(C)C(C)(C)C)CCN1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.37
SLC6A3 Q01959 1/20 0.37
ARG1 P05089 1/20 0.36
HTR2C P28335 1/20 0.33
GRIN2D O15399 2/20 0.32
GRIN3B O60391 2/20 0.32
GRIN1 Q05586 2/20 0.32
GRIN2A Q12879 2/20 0.32
GRIN2B Q13224 2/20 0.32
GRIN2C Q14957 2/20 0.32
GRIN3A Q8TCU5 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
THRB P10828 1/20 0.32
ALOX15 P16050 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
GRIA1 P42261 1/20 0.32
GRIA2 P42262 1/20 0.32

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
SCHEMBL4148708 0.76 FKBP1A (0.32) ARG1FKBP1A
SCHEMBL9518643 0.75 ARG1 (0.45) DRD3SLC6A3ARG1GRIN2DGRIN3B
SCHEMBL9518650 0.75 ARG1 (0.45) DRD3SLC6A3ARG1GRIN2DGRIN3B
SCHEMBL9518656 0.75 ARG1 (0.45) DRD3SLC6A3ARG1GRIN2DGRIN3B
SCHEMBL5516670 0.75 DRD3 (0.46) DRD3SLC6A3ARG1HTR2CGRIN2D
SCHEMBL31436224 0.73 PIM2 (0.35)
SCHEMBL5527376 0.73 DRD3 (0.45) DRD3SLC6A3ARG1HTR2CGRIN2D
SCHEMBL26246248 0.72 P2RX3 (0.31)
SCHEMBL23214633 0.72 GRIN2D (0.41) DRD3SLC6A3ARG1GRIN2DGRIN3B
SCHEMBL20215670 0.72 DUT (0.35) DUT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1814893-A2 NOVEL LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2007-08-08 EP disclosed
WO-2006055070-A2 NOVEL LINCOMYCIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2006-05-26 WO disclosed
EP-1644393-A2 NOVEL LINCOMYCIN DERIVATIVES POSSESSING ANTIMICROBIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2006-04-12 EP disclosed
WO-2005012320-A2 NOVEL LINCOMYCIN DERIVATIVES POSSESSING ANTIMICROBIAL ACTIVITY VICURON PHARMACEUTICALS, INC. (US) 2005-02-10 WO disclosed