SCHEMBL9623403

SCHEMBL9623403

COC(=O)c1cccc(CC=CO[Si](C)(C)C)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.55
CYP4F2 P78329 2/20 0.54
CYP4A11 Q02928 2/20 0.54
SLC7A5 Q01650 1/20 0.48
ABHD6 Q9BV23 1/20 0.46
FOLH1 Q04609 1/20 0.45
MRGPRX4 Q96LA9 3/20 0.45
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
RAB9A P51151 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
HIF1A Q16665 1/20 0.43
HTT P42858 1/20 0.43
TSHR P16473 1/20 0.43
GSK3B P49841 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL9623398 1.00 LOXL2 (0.55) LOXL2CYP4F2CYP4A11SLC7A5ABHD6
SCHEMBL9442216 0.83 LOXL2 (0.50) LOXL2CYP4F2CYP4A11MEN1NPC1
SCHEMBL9442219 0.83 LOXL2 (0.50) LOXL2CYP4F2CYP4A11MEN1NPC1
SCHEMBL4682498 0.81 LOXL2 (0.67) LOXL2CYP4F2CYP4A11SLC7A5ABHD6
SCHEMBL697890 0.79 LOXL2 (0.68) LOXL2CYP4F2CYP4A11SLC7A5ABHD6
SCHEMBL13601337 0.79 LOXL2 (0.59) LOXL2CYP4F2CYP4A11SLC7A5ABHD6
SCHEMBL757447 0.77 LOXL2 (0.64) LOXL2CYP4F2CYP4A11SLC7A5ABHD6
SCHEMBL8367820 0.74 LOXL2 (0.60) LOXL2CYP4F2CYP4A11SLC7A5FOLH1
SCHEMBL126284 0.74 LOXL2 (0.74) LOXL2CYP4F2CYP4A11SLC7A5FOLH1
SCHEMBL70173 0.74 CYP4F2 (0.83) LOXL2CYP4F2CYP4A11SLC7A5FOLH1

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
EP-0235452-B1 ORGANIC COMPOUNDS AND THEIR PHARMACEUTICAL USE LILLY INDUSTRIES LIMITED (GB) 1992-03-18 EP disclosed
US-4845110-A Organic compounds and their pharmaceutical use LILLY INDUSTRIES LIMITED (GB) 1989-07-04 US disclosed
EP-0235452-A2 Organic compounds and their pharmaceutical use LILLY INDUSTRIES LIMITED (GB) 1987-09-09 EP disclosed