SCHEMBL4446385

SCHEMBL4446385

C=Cc1cccc(CC)c1N(CC)CC

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.36
GABRB2 P47870 4/20 0.36
TP53 P04637 2/20 0.33
CRHR1 P34998 2/20 0.33
ALDH1A1 P00352 4/20 0.32
ALDH1A3 P47895 2/20 0.32
ALDH3A1 P30838 1/20 0.32
ESR1 P03372 2/20 0.31
CYP3A4 P08684 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
NR1I2 O75469 1/20 0.31
PLK1 P53350 1/20 0.30
AR P10275 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL10399130 0.80 GABRA1 (0.48) GABRA1GABRB2TP53CRHR1ALDH1A1
SCHEMBL9009244 0.76 ALDH1A1 (0.48) ALDH1A1ALDH3A1TDP1MEN1KMT2A
SCHEMBL420437 0.75 GABRA1 (0.43) GABRA1GABRB2CRHR1ALDH1A1MEN1
SCHEMBL29749448 0.74 ALDH1A1 (0.44) GABRA1GABRB2TP53ALDH1A1TDP1
SCHEMBL14959 0.74 ALDH1A1 (0.44) GABRA1GABRB2TP53ALDH1A1TDP1
SCHEMBL59712 0.73 GABRA1 (0.41) GABRA1GABRB2CRHR1ALDH1A1
SCHEMBL110775 0.73 GABRA1 (0.41) GABRA1GABRB2TP53CRHR1ALDH1A1
SCHEMBL29407303 0.73 GABRA1 (0.41) GABRA1GABRB2CRHR1ALDH1A1
SCHEMBL3679758 0.73 NR3C1 (0.33) ALDH1A1ALDH1A3CYP3A4KMT2A
SCHEMBL9576114 0.72 ALDH1A1 (0.43) GABRA1GABRB2TP53ALDH1A1TDP1

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 66 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180318773-A1 COMPOSITE MATERIAL COMPRISING A NON-CROSSLINKED GEL POLYMER MCMASTER UNIVERSITY 2018-11-08 US claimed
CN-108473621-A Modifier, modified conjugated diene polymer and preparation method thereof 株式会社LG化学 2018-08-31 CN claimed
CN-108473620-A Modified conjugated diene polymer and preparation method thereof 株式会社LG化学 2018-08-31 CN claimed
CN-105051605-A Lithographically produced features UNIV QUEENSLAND 2015-11-11 CN claimed
CN-101039744-B Composite material comprising a non-crosslinked gel polymer UNIV MCMASTER 2010-05-05 CN claimed
US-7632905-B2 Block copolymer, composition comprising it and cosmetic treatment process L'OREAL S.A. (FR) 2009-12-15 US claimed
CN-100548455-C The composite that comprises layered hydrophilic coatings UNIV MCMASTER (CA) 2009-10-14 CN claimed
EP-1776176-A4 COMPOSITE MATERIAL COMPRISING A NON-CROSSLINKED GEL POLYMER UNIV MCMASTER (CA) 2008-12-24 EP claimed
JP-2007532711-A 2007-11-15 JP claimed
CN-101048222-A Composite material comprising layered hydrophilic coatings UNIV MCMASTER (CA) 2007-10-03 CN claimed
CN-101039744-A Composite material comprising a non-crosslinked gel polymer UNIV MCMASTER (CA) 2007-09-19 CN claimed
EP-1776176-A1 COMPOSITE MATERIAL COMPRISING A NON-CROSSLINKED GEL POLYMER McMaster University (CA) 2007-04-25 EP claimed
EP-1732964-A2 SEQUENCED COPOLYMER Arkema France (FR) 2006-12-20 EP claimed
WO-2006015495-A1 COMPOSITE MATERIAL COMPRISING A NON-CROSSLINKED GEL POLYMER MCMASTER UNIVERSITY (CA) 2006-02-16 WO claimed
WO-2005103102-A2 SEQUENCED COPOLYMER ARKEMA FRANCE (FR) 2005-11-03 WO claimed
CN-117836384-A Single layer adhesive film and related articles 3M创新有限公司 2024-04-05 CN disclosed
CN-116888768-A Modified graphite and preparation method thereof, secondary battery, battery module, battery pack and power utilization device 宁德时代新能源科技股份有限公司 2023-10-13 CN disclosed
EP-1732964-A2 SEQUENCED COPOLYMER Arkema France (FR) 2006-12-20 EP disclosed
WO-2006015495-A1 COMPOSITE MATERIAL COMPRISING A NON-CROSSLINKED GEL POLYMER MCMASTER UNIVERSITY (CA) 2006-02-16 WO disclosed
WO-2005103102-A2 SEQUENCED COPOLYMER ARKEMA FRANCE (FR) 2005-11-03 WO disclosed