SCHEMBL4520474

SCHEMBL4520474

Nc1ccc(CCCC[SiH](O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.57
GFER P55789 1/20 0.52
MAOA P21397 2/20 0.45
CYP3A4 P08684 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTR2A P28223 2/20 0.39
CYP19A1 P11511 2/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
RECQL P46063 1/20 0.38
NPC1 O15118 1/20 0.36
CYP2D6 P10635 1/20 0.36
NOS1 P29475 1/20 0.36
RAB9A P51151 1/20 0.36
HIF1A Q16665 1/20 0.36

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
SCHEMBL3111509 0.82 MAOB (0.80) MAOBGFERMAOACYP3A4ALDH1A1
SCHEMBL4021564 0.79 MAOB (0.76) MAOBGFERMAOACYP3A4ALDH1A1
SCHEMBL4022346 0.79 MAOB (0.76) MAOBGFERMAOACYP3A4ALDH1A1
SCHEMBL4020173 0.79 MAOB (0.76) MAOBGFERMAOACYP3A4ALDH1A1
SCHEMBL4016462 0.79 MAOB (0.76) MAOBGFERMAOACYP3A4ALDH1A1
SCHEMBL4020067 0.79 MAOB (0.76) MAOBGFERMAOACYP3A4ALDH1A1
SCHEMBL20251158 0.79 MAOB (0.76) MAOBGFERMAOACYP3A4ALDH1A1
SCHEMBL12110816 0.79 MAOB (0.76) MAOBGFERMAOACYP3A4ALDH1A1
SCHEMBL4016540 0.79 MAOB (0.76) MAOBGFERMAOACYP3A4ALDH1A1
SCHEMBL10608209 0.78 MAOA (0.52) MAOBMAOATDP1SIGMAR1NOS1

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