SCHEMBL3674751

SCHEMBL3674751

CC(C)(O)C(=O)c1ccc(CN2CCOCC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.59
HPGD P15428 1/20 0.58
KMT2A Q03164 1/20 0.55
HIF1A Q16665 4/20 0.54
EPAS1 Q99814 4/20 0.54
NPC1 O15118 3/20 0.53
RAB9A P51151 2/20 0.53
ALDH1A1 P00352 1/20 0.53
KDM4E B2RXH2 1/20 0.53
MAPK1 P28482 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
AOC3 Q16853 1/20 0.52

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
SCHEMBL21119731 0.90 HRH3 (0.60) HRH3HPGDKMT2AHIF1AEPAS1
SCHEMBL3670808 0.87 ALDH1A1 (0.62) HRH3HPGDKMT2AHIF1AEPAS1
SCHEMBL14700252 0.83 ABL1 (0.53) HRH3HPGDHIF1AEPAS1NPC1
SCHEMBL3673130 0.82 CYP2C9 (0.49) HRH3HPGDKMT2AKDM4E
SCHEMBL540760 0.81 HRH3 (0.65) HRH3HPGDKMT2AHIF1AEPAS1
SCHEMBL8027548 0.81 HPGD (0.68) HRH3HPGDKMT2AHIF1AEPAS1
SCHEMBL426993 0.80 HPGD (0.66) HRH3HPGDKMT2AHIF1AEPAS1
SCHEMBL5839656 0.80 HPGD (0.66) HRH3HPGDKMT2AHIF1AEPAS1
SCHEMBL1177221 0.80 HPGD (0.66) HRH3HPGDKMT2AHIF1AEPAS1
SCHEMBL18413640 0.80 HPGD (0.66) HRH3HPGDKMT2AHIF1AEPAS1

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 10 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-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-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
US-20070240609-A1 Photoinitiators IGM GROUP B.V. (NL) 2007-10-18 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-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