SCHEMBL4533827

SCHEMBL4533827

NCCCc1ccccc1[SiH](O)O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 8/20 0.41
MAOA P21397 1/20 0.38
CYP2A6 P11509 2/20 0.36
KIF11 P52732 1/20 0.35
HTR2A P28223 4/20 0.34
MPO P05164 1/20 0.34
SLC6A4 P31645 1/20 0.34
HMGB1 P09429 1/20 0.33
CHEK1 O14757 1/20 0.33
HRH1 P35367 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LOXL2 Q9Y4K0 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
SCHEMBL7743404 0.80 TAAR1 (0.41) TAAR1MAOACYP2A6KIF11HTR2A
SCHEMBL2525305 0.80 LIPG (0.47)
SCHEMBL6841740 0.80 ALDH1A1 (0.35) MPOSLC6A4
SCHEMBL29943451 0.78 TAAR1 (0.50) TAAR1MAOACYP2A6KIF11HTR2A
SCHEMBL3678681 0.78 TAAR1 (0.50) TAAR1MAOACYP2A6KIF11HTR2A
SCHEMBL1931186 0.76 TAAR1 (0.42) TAAR1MAOAKIF11HTR2AHRH1
SCHEMBL1780725 0.75 LIPG (0.37)
SCHEMBL15643398 0.73 TAAR1 (0.33) TAAR1CHEK1
SCHEMBL4530303 0.73 MPO (0.44) HTR2AMPOSLC6A4
SCHEMBL1069351 0.73 TAAR1 (0.36) TAAR1MAOAKIF11HTR2AHRH1

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