SCHEMBL3862597

SCHEMBL3862597

C=CC(CCCC)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.50
CA1 P00915 4/20 0.50
TSHR P16473 3/20 0.40
ACHE P22303 1/20 0.38
BACE1 P56817 1/20 0.38
MAPK1 P28482 1/20 0.38
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
EPHX1 P07099 1/20 0.36
HPGD P15428 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
SLC15A1 P46059 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
FDPS P14324 1/20 0.34
MEN1 O00255 1/20 0.34
FAAH O00519 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 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
SCHEMBL13493335 0.94 CA1 (0.44) CA2CA1SLC1A2SLC1A1EPHX1
SCHEMBL4474432 0.92 GPR84 (0.42) CA2CA1EPHX1MEN1FAAH
SCHEMBL7788154 0.92 GPR84 (0.42) CA2CA1EPHX1MEN1FAAH
SCHEMBL28754635 0.92 GPR84 (0.42) CA2CA1EPHX1MEN1FAAH
SCHEMBL4457882 0.92 GPR84 (0.42) CA2CA1EPHX1MEN1FAAH
SCHEMBL8011567 0.87
SCHEMBL3264015 0.83 TSHR (0.42) CA2CA1TSHRACHEBACE1
SCHEMBL323960 0.81 CA2 (0.48) CA2CA1TSHRACHEBACE1
SCHEMBL29956768 0.81 CA2 (0.48) CA2CA1TSHRACHEBACE1
SCHEMBL8014889 0.81 CA2 (0.52) CA2CA1TSHRMAPK1SLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160304366-A1 METHODS FOR REMOVING CONTAMINANTS FROM AQUEOUS SYSTEMS KEMIRA OYJ (FI) 2016-10-20 US claimed
CN-118580409-A Process for producing vinyl chloride polymer, and vinyl chloride polymer latex, paste resin, liquid composition, and solid composition 北京化工大学 2024-09-03 CN disclosed
CN-118126229-A Process for producing vinyl chloride copolymer, and vinyl chloride copolymer latex, paste resin, liquid composition, and solid composition 北京化工大学 2024-06-04 CN disclosed
US-20180071752-A1 Depressants for Mineral Ore Flotation KEMIRA OYJ (FI) 2018-03-15 US disclosed
US-20170368480-A1 Selective Flocculants for Mineral Ore Benefication KEMIRA OYJ (FI) 2017-12-28 US disclosed
CN-107427842-A Selective flocculant for ore beneficiation 凯米罗总公司 2017-12-01 CN disclosed
CN-107427841-A Depressants for ore flotation 凯米罗总公司 2017-12-01 CN disclosed
EP-3240637-A1 DEPRESSANTS FOR MINERAL ORE FLOTATION KEMIRA OYJ (FI) 2017-11-08 EP disclosed
EP-3237115-A1 SELECTIVE FLOCCULANTS FOR MINERAL ORE BENEFICIATION KEMIRA OYJ (FI) 2017-11-01 EP disclosed
CN-105037665-B A kind of titanium dioxide nano-particle of surface grafting Vinylcaprolactam homopolymer and preparation method thereof 哈尔滨工业大学 2017-07-28 CN disclosed
US-20160304366-A1 METHODS FOR REMOVING CONTAMINANTS FROM AQUEOUS SYSTEMS KEMIRA OYJ (FI) 2016-10-20 US disclosed
WO-2016106131-A1 SELECTIVE FLOCCULANTS FOR MINERAL ORE BENEFICIATION MOORE LUCAS (US) 2016-06-30 WO disclosed
US-20090105097-A1 Degradable Friction Reducer SCHLUMBERGER TECHNOLOGY CORPORATION 2009-04-23 US disclosed