SCHEMBL3675460

SCHEMBL3675460

CNC(c1ccccc1)c1ccc(C(=O)C(C)(C)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.42
HPGDS O60760 1/20 0.41
LMNA P02545 2/20 0.41
SRC P12931 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
ALDH1A1 P00352 3/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 2/20 0.40
CHRM2 P08172 1/20 0.40
ADRA1A P35348 1/20 0.40
RGS12 O14924 1/20 0.40
GLA P06280 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
ADRA2C P18825 1/20 0.40

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
SCHEMBL4422781 0.93 MLYCD (0.35) OPRD1HPGDSLMNASRCHDAC1
SCHEMBL3674923 0.81 SRD5A2 (0.47) LMNASRCHDAC1HDAC8HDAC6
SCHEMBL4427943 0.79 GABRB1 (0.48) OPRD1LMNAHDAC1HDAC6KMT2A
SCHEMBL1409972 0.78 CYP2C9 (0.49) LMNASRCALDH1A1CYP2D6CYP2C9
SCHEMBL3975579 0.77 FFAR1 (0.47) LMNACYP2C19POLBMAPTHPGD
SCHEMBL3678671 0.77 SRC (0.44) OPRD1SRCHDAC1HDAC8HDAC6
SCHEMBL4425374 0.77 TP53BP1 (0.36) OPRD1HPGDSLMNASRCALDH1A1
SCHEMBL4418971 0.77 RAB9A (0.47) OPRD1HDAC8HDAC6CYP3A4CYP2D6
Acetic Acid SCHEMBL9853096 0.77 LMNA (0.47) HPGDSLMNASRCHDAC1HDAC8
SCHEMBL21310 0.76 CES1 (0.56) LMNASRCALDH1A1CYP3A4TSHR

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