SCHEMBL5576557

SCHEMBL5576557

CC[Si](CC)(CC)CCCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.50
GPR84 Q9NQS5 7/20 0.48
PPARG P37231 7/20 0.48
PPARD Q03181 7/20 0.48
PPARA Q07869 7/20 0.48
HDAC11 Q96DB2 5/20 0.48
TSHR P16473 5/20 0.48
PTPN1 P18031 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
FABP4 P15090 2/20 0.48
SLC22A6 Q4U2R8 2/20 0.48
SLC22A8 Q8TCC7 1/20 0.48
MEN1 O00255 1/20 0.48
ESR1 P03372 1/20 0.48
ALOX15 P16050 1/20 0.48
PDE4A P27815 1/20 0.48
KMT2A Q03164 1/20 0.48
PDE3A Q14432 1/20 0.48

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
SCHEMBL22322025 0.91 GPR84 (0.56) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL8559186 0.84 FFAR3 (0.48) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL11362445 0.79 GPR84 (0.67) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL29683545 0.78 AKR1B1 (0.48) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL5403973 0.77 LMNA (0.50) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL514623 0.75 AKR1B1 (0.44) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL2786329 0.74 LMNA (0.53) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL18237528 0.74 LMNA (0.53) AKR1B1GPR84PPARGPPARDPPARA
Hydrochloric Acid SCHEMBL11151061 0.72 LMNA (0.50) AKR1B1GPR84PPARGPPARDPPARA
Hexanoate SCHEMBL27684603 0.72 AKR1B1 (0.84) AKR1B1GPR84PPARGPPARDPPARA

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