SCHEMBL3671753

SCHEMBL3671753

CC(C)(O)C(=O)c1ccc(C(C)(C)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.42
SRD5A2 P31213 1/20 0.41
CA2 P00918 1/20 0.39
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HTT P42858 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.37
HIF1A Q16665 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
POLB P06746 1/20 0.37
RARB P10826 1/20 0.37
RARG P13631 1/20 0.37
HSD11B1 P28845 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
MLYCD O95822 2/20 0.36
SIRT1 Q96EB6 1/20 0.36
MAP3K5 Q99683 1/20 0.35

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
SCHEMBL11298330 0.88 CA2 (0.46) HDAC1SRD5A2CA2ALDH1A1CES2
SCHEMBL10716855 0.86 HDAC1 (0.42) HDAC1SRD5A2CA2MEN1ALDH1A1
SCHEMBL3685029 0.86 ESR1 (0.46) HDAC1SRD5A2CA2MEN1ALDH1A1
SCHEMBL305930 0.86 HDAC1 (0.57) HDAC1SRD5A2MEN1ALDH1A1HTT
SCHEMBL547696 0.86 HDAC1 (0.42) HDAC1SRD5A2CA2MEN1ALDH1A1
SCHEMBL4422774 0.83 HDAC1 (0.39) HDAC1SRD5A2CA2MEN1ALDH1A1
SCHEMBL15251658 0.81 RXRA (0.44) CA2MAPTNPC1RAB9AMLYCD
SCHEMBL4419639 0.81 ALDH1A1 (0.50) SRD5A2CA2ALDH1A1HTTMAPT
SCHEMBL10943093 0.81 CES2 (0.50) CA2RAB9ACES2CES1
SCHEMBL547765 0.81 SRD5A2 (0.59) HDAC1SRD5A2ALDH1A1HTTMAPT

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 5 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
EP-1763499-A1 NEW PHOTOINITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-03-21 EP disclosed
WO-2005100292-A1 NEW PHOTOINITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-10-27 WO disclosed