SCHEMBL8961186

SCHEMBL8961186

COC(OC)[SiH2]CCc1ccc(CN)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 3/20 0.38
TAAR1 Q96RJ0 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
MAOB P27338 5/20 0.36
F2 P00734 1/20 0.35
ABAT P80404 1/20 0.34
F11 P03951 1/20 0.34
ST14 Q9Y5Y6 1/20 0.34
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
PSIP1 O75475 1/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 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
SCHEMBL163506 0.90 TAAR1 (0.34) TAAR1MAOB
SCHEMBL15329316 0.83 CYP1A2 (0.42) TAAR1HRH3
SCHEMBL2246130 0.79 TAAR1 (0.38) TAAR1HRH3
SCHEMBL2244720 0.77 IDO1 (0.30)
SCHEMBL10612702 0.76 MAOB (0.49) TAAR1MAOB
SCHEMBL2244712 0.73
SCHEMBL31070320 0.70 IDO1 (0.41)
SCHEMBL2242171 0.68 CASR (0.31) TAAR1
SCHEMBL57613 0.68
SCHEMBL8361977 0.68 GFER (0.43) LOXL2TAAR1MAOB

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
EP-0618246-B1 Aqueous silylated epoxy resin dispersion OSI SPECIALTIES INC (US) 1996-01-31 EP disclosed
EP-0618246-A2 Aqueous silylated epoxy resin dispersion OSi Specialties, Inc. (US) 1994-10-05 EP disclosed