SCHEMBL3667698

SCHEMBL3667698

COCc1ccc(C(=O)C(C)(C)O)cc1CO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 3/20 0.40
PKM P14618 1/20 0.38
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 2/20 0.34
KMT2A Q03164 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 2/20 0.33
CYBB P04839 1/20 0.33
PRKCE Q02156 1/20 0.33
GCGR P47871 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HTR7 P34969 1/20 0.31
HTR2B P41595 1/20 0.31
MLYCD O95822 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
SCHEMBL3673304 0.94 ACE2 (0.40) ACE2PKMMEN1ALDH1A1KMT2A
SCHEMBL3670792 0.92 MEN1 (0.36) ACE2PKMMEN1ALDH1A1KMT2A
SCHEMBL3677422 0.89 ACE2 (0.40) ACE2PKMCYBBMLYCDEPHX2
SCHEMBL3673889 0.88 ALDH1A1 (0.34) ACE2PKMMEN1ALDH1A1KMT2A
SCHEMBL3674798 0.88 ALDH1A1 (0.34) ACE2PKMMEN1ALDH1A1KMT2A
SCHEMBL3671819 0.88 ALDH1A1 (0.34) ACE2PKMMEN1ALDH1A1KMT2A
SCHEMBL3671847 0.87 ACE2 (0.45) ACE2PKMCYBBMLYCDEPHX2
SCHEMBL3672629 0.87 ACE2 (0.39) ACE2PKMCYBBEPHX2
SCHEMBL3675044 0.85 ALDH1A1 (0.47) MEN1ALDH1A1KMT2AGAAMAPT
SCHEMBL3671501 0.83 ACE2 (0.40) ACE2PKMCYBBMLYCDEPHX2

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
US-7642296-B2 2-hydroxy-1-(4-hydroxymethyl-phenyl)-2-methyl-propan-1-one, have higher reactivity at the benzylic hydroxy group and do not have a tendency to yellowing; photocurable composition for pigmented or non-pigmented varnish surface coatings CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-01-05 US disclosed
US-20070240609-A1 Photoinitiators IGM GROUP B.V. (NL) 2007-10-18 US disclosed
EP-1763499-B1 NEW PHOTOINITIATORS CIBA SC HOLDING AG (CH) 2007-09-26 EP disclosed