SCHEMBL3668232

SCHEMBL3668232

CCc1cc(C(=O)C(C)(C)O)ccc1CO

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 3/20 0.43
PKM P14618 1/20 0.42
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
MLYCD O95822 2/20 0.36
EPHX2 P34913 1/20 0.33
ACHE P22303 1/20 0.33
CTNNB1 P35222 1/20 0.33
HSD17B1 P14061 1/20 0.33
KLF10 Q13118 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL3671847 0.93 ACE2 (0.45) ACE2PKMHSP90AA1HSP90AB1MLYCD
SCHEMBL3671501 0.85 ACE2 (0.40) ACE2PKMMLYCDEPHX2ACHE
SCHEMBL3676655 0.85 ALDH1A1 (0.43) ACE2PKMALDH1A1
SCHEMBL3673304 0.84 ACE2 (0.40) ACE2PKMALDH1A1
SCHEMBL3672629 0.83 ACE2 (0.39) ACE2PKMEPHX2
SCHEMBL3669475 0.83 ACE2 (0.43) ACE2PKMMLYCDEPHX2ACHE
SCHEMBL3676253 0.83 PKM (0.46) ACE2PKMEPHX2HSD17B1KLF10
SCHEMBL3677422 0.82 ACE2 (0.40) ACE2PKMMLYCDEPHX2ACHE
SCHEMBL3672838 0.81 PKM (0.41) ACE2PKMEPHX2KLF10
SCHEMBL3667698 0.81 ACE2 (0.40) ACE2PKMMLYCDEPHX2ALDH1A1

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