SCHEMBL1121945

SCHEMBL1121945

C#Cc1cc(C)ccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.52
TP53 P04637 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALOX15 P16050 3/20 0.46
HSD17B10 Q99714 2/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 5/20 0.45
MAPT P10636 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
ALOX12 P18054 1/20 0.45
CSNK2A1 P68400 1/20 0.42
AMY1A P0DUB6 1/20 0.39
CHRM1 P11229 1/20 0.39
SLC6A2 P23975 1/20 0.39
ADRA1A P35348 1/20 0.39
HTR2B P41595 1/20 0.39
RAB9A P51151 3/20 0.38

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
SCHEMBL3843168 0.78 CYP2A6 (0.39) TRPA1TP53TDP1ALOX15HSD17B10
SCHEMBL6895905 0.77 TRPA1 (0.52) TRPA1TP53TDP1ALOX15HSD17B10
SCHEMBL1853181 0.77 TRPA1 (0.52) TRPA1TP53TDP1ALOX15HSD17B10
SCHEMBL13763432 0.77 TRPA1 (0.42) TRPA1TP53TDP1ALOX15HSD17B10
SCHEMBL358267 0.76 ESR1 (0.44) ALOX15HSD17B10ALDH1A1LMNAHTT
SCHEMBL29771448 0.76 ESR1 (0.44) ALOX15HSD17B10ALDH1A1LMNAHTT
SCHEMBL11420886 0.76 APP (0.48) ALOX15HSD17B10ALDH1A1LMNAMAPT
SCHEMBL3220960 0.76 TDP1 (0.42) TRPA1TP53TDP1ALOX15HSD17B10
SCHEMBL2809328 0.73 HSD17B10 (0.50) TDP1ALOX15HSD17B10ALDH1A1LMNA
SCHEMBL12225260 0.73 TDP1 (0.52) TP53TDP1ALOX15HSD17B10ALDH1A1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111100101-B Catalytic synthesis method of 3-benzofuranone compounds 浙江万里学院 2022-11-11 CN disclosed
CN-111100101-A Catalytic synthesis method of 3-benzofuranone compounds 浙江万里学院 2020-05-05 CN disclosed
US-20130102740-A1 SULFONATED POLY(ARYLENE ETHER) COPOLYMER HAVING A CROSS-LINKABLE STRUCTURE, AND POLYELECTROLYTE MEMBRANE COMPRISING SAME GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-04-25 US disclosed
EP-2176243-B1 OPHTHALMIC LENS MATERIALS CONTAINING CHROMOPHORES THAT ABSORB BOTH UV AND SHORT WAVELENGTH VISIBLE LIGHT ALCON INC (CH) 2011-02-09 EP disclosed
EP-2176243-B1 OPHTHALMIC LENS MATERIALS CONTAINING CHROMOPHORES THAT ABSORB BOTH UV AND SHORT WAVELENGTH VISIBLE LIGHT ALCON INC (CH) 2011-02-09 EP disclosed
US-7728051-B2 Ophthalmic lens materials containing chromophores that absorb both UV and short wavelength visible light ALCON, INC. (CH) 2010-06-01 US disclosed
US-7728051-B2 Ophthalmic lens materials containing chromophores that absorb both UV and short wavelength visible light ALCON, INC. (CH) 2010-06-01 US disclosed
US-7728051-B2 Ophthalmic lens materials containing chromophores that absorb both UV and short wavelength visible light ALCON, INC. (CH) 2010-06-01 US disclosed
EP-2176243-A1 OPHTHALMIC LENS MATERIALS CONTAINING CHROMOPHORES THAT ABSORB BOTH UV AND SHORT WAVELENGTH VISIBLE LIGHT Alcon, Inc. (CH) 2010-04-21 EP disclosed
WO-2010003533-A2 ANTI-INFECTIVE COMPOUNDS INSTITUT PASTEUR KOREA (KR) 2010-01-14 WO disclosed
WO-2009021085-A1 OPHTHALMIC LENS MATERIALS CONTAINING CHROMOPHORES THAT ABSORB BOTH UV AND SHORT WAVELENGTH VISIBLE LIGHT ALCON, INC. (CH) 2009-02-12 WO disclosed
WO-2009021085-A1 OPHTHALMIC LENS MATERIALS CONTAINING CHROMOPHORES THAT ABSORB BOTH UV AND SHORT WAVELENGTH VISIBLE LIGHT ALCON, INC. (CH) 2009-02-12 WO disclosed
US-20090043007-A1 OPHTHALMIC LENS MATERIALS CONTAINING CHROMOPHORES THAT ABSORB BOTH UV AND SHORT WAVELENGTH VISIBLE LIGHT ALCON, INC. (CH) 2009-02-12 US disclosed
US-20090043007-A1 OPHTHALMIC LENS MATERIALS CONTAINING CHROMOPHORES THAT ABSORB BOTH UV AND SHORT WAVELENGTH VISIBLE LIGHT ALCON, INC. (CH) 2009-02-12 US disclosed
US-20090043007-A1 OPHTHALMIC LENS MATERIALS CONTAINING CHROMOPHORES THAT ABSORB BOTH UV AND SHORT WAVELENGTH VISIBLE LIGHT ALCON, INC. (CH) 2009-02-12 US disclosed