SCHEMBL3673792

SCHEMBL3673792

CN(C)Cc1ccc(C(=O)C(C)(C)O)cc1CO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ACE2 Q9BYF1 1/20 0.40
SLC6A4 P31645 9/20 0.39
SLC6A2 P23975 6/20 0.39
SLC6A3 Q01959 2/20 0.39
CYP2C19 P33261 2/20 0.38
CYP1A2 P05177 1/20 0.38
PKM P14618 1/20 0.38
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
CA2 P00918 2/20 0.35
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
G6PD P11413 1/20 0.34

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
SCHEMBL3676655 0.95 ALDH1A1 (0.43) ALDH1A1MEN1KMT2AACE2SLC6A4
SCHEMBL3671777 0.94 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AACE2SLC6A4
SCHEMBL3671847 0.87 ACE2 (0.45) ACE2PKM
SCHEMBL3679218 0.84 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ASLC6A4SLC6A2
SCHEMBL3675044 0.82 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ASLC6A4SLC6A2
SCHEMBL3668232 0.81 ACE2 (0.43) ALDH1A1ACE2PKM
SCHEMBL3677422 0.80 ACE2 (0.40) ACE2PKMMAPK1
SCHEMBL3667698 0.79 ACE2 (0.40) ALDH1A1MEN1KMT2AACE2PKM
SCHEMBL3672629 0.78 ACE2 (0.39) ACE2PKMMAPK1
SCHEMBL3669475 0.78 ACE2 (0.43) ALDH1A1ACE2PKMHTTKDM4E

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