SCHEMBL4529808

SCHEMBL4529808

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
FAAH O00519 1/20 0.33
PAOX Q6QHF9 2/20 0.32
KDM4E B2RXH2 3/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 2/20 0.31
SMOX Q9NWM0 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
GAA P10253 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 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
SCHEMBL4523024 0.82 PAOX (0.38) KDM1ACNR1CNR2PAOXKDM4E
SCHEMBL4524282 0.80 PAOX (0.37) KDM1ACNR1CNR2FAAHPAOX
SCHEMBL4535976 0.79 KDM1A (0.36) KDM1ACNR1CNR2FAAHPAOX
SCHEMBL4521496 0.76 CYP2C19 (0.48) KDM1APAOXKMT2AALDH1A1MEN1
SCHEMBL3023756 0.74 PAOX (0.50) KDM1ACNR1CNR2PAOXKDM4E
SCHEMBL89641 0.73
SCHEMBL821376 0.73 KDM1A (0.34) KDM1ACNR1CNR2PAOXKDM4E
Hydrochloric Acid SCHEMBL3024738 0.72 SMOX (0.52) KDM1APAOXKDM4EKMT2AALDH1A1
SCHEMBL5611725 0.72 PAOX (0.48) KDM1ACNR1CNR2PAOXKDM4E
SCHEMBL17291817 0.72 PAOX (0.48) KDM1ACNR1CNR2PAOXKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7507480-B2 Corrosion-resistant metal surfaces BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) 2009-03-24 US disclosed
US-20060269760-A1 Corrosion-resistant metal surfaces ENERGY, UNITED STATES DEPARTMENT OF 2006-11-30 US disclosed