SCHEMBL5576560

SCHEMBL5576560

CCC(C(=O)O)[Si](CC)(CC)CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 2/20 0.38
SLC1A2 P43004 2/20 0.38
SLC1A1 P43005 2/20 0.38
CHRM1 P11229 1/20 0.35
AKR1A1 P14550 1/20 0.35
CHRM3 P20309 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
ADRA1A P35348 1/20 0.35
HRH1 P35367 1/20 0.35
DRD3 P35462 1/20 0.35
SLC6A3 Q01959 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CA2 P00918 1/20 0.34
MAPK1 P28482 1/20 0.34
GABRR1 P24046 2/20 0.32
SLC7A5 Q01650 2/20 0.32
FFAR3 O14843 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
SCHEMBL654433 0.76 CHRM1 (0.36) SLC1A3SLC1A2SLC1A1CHRM1AKR1A1
SCHEMBL5404993 0.74 CHRM1 (0.35) SLC1A3SLC1A2SLC1A1CHRM1AKR1A1
SCHEMBL9335768 0.70 TP53 (0.38) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL2783708 0.70 CA2 (0.32) SLC1A3SLC1A2SLC1A1CHRM1AKR1A1
SCHEMBL1971029 0.70 CA2 (0.32) SLC1A3SLC1A2SLC1A1CHRM1AKR1A1
SCHEMBL31396679 0.69 CA1 (0.39) SLC1A3SLC1A2SLC1A1CHRM1AKR1A1
SCHEMBL5067300 0.67 CA2 (0.30) CHRM1AKR1A1CHRM3HTR2AHTR2C
Ethylmalonate SCHEMBL107241 0.64
SCHEMBL427560 0.63
Hydroxyamine SCHEMBL4703121 0.63 CA2 (0.64) SLC1A3SLC1A2SLC1A1CHRM1AKR1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455047-B2 Method for growing carbon nanotubes on clay platelets APPLIED NANOTECH HOLDINGS, INC. (US) 2013-06-04 US disclosed
US-20120128878-A1 Nano-Filler for Composites NANO-PROPRIETARY, INC. (US) 2012-05-24 US disclosed
WO-2007127906-A1 NANO-FILLER FOR COMPOSITES NANO-PROPRIETARY, INC. (US) 2007-11-08 WO disclosed