SCHEMBL111287

SCHEMBL111287

N#[N+]c1ccc(CN)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.50
LOXL2 Q9Y4K0 7/20 0.48
ABAT P80404 1/20 0.46
TAAR1 Q96RJ0 1/20 0.42
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
F10 P00742 1/20 0.39
F11 P03951 1/20 0.39
CA12 O43570 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
ST14 Q9Y5Y6 1/20 0.39
MAPT P10636 1/20 0.38
PSIP1 O75475 1/20 0.37
ADRB2 P07550 1/20 0.37

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
Hydrochloric Acid SCHEMBL2502782 0.97 HRH3 (0.48) HRH3LOXL2ABATTAAR1CA1
SCHEMBL23356017 0.91 LOXL2 (0.44) HRH3LOXL2ABATTAAR1CA1
SCHEMBL27641801 0.91 LOXL2 (0.44) HRH3LOXL2ABATTAAR1CA1
SCHEMBL1535981 0.80 TAAR1 (0.50) LOXL2TAAR1CA1CA2CA12
SCHEMBL19416225 0.78 ALDH1A1 (0.44) CA1CA2CA4CA6LTA4H
SCHEMBL27238704 0.76 HRH3 (0.79) HRH3LOXL2ABATTAAR1CA1
SCHEMBL15828 0.76 HRH3 (0.79) HRH3LOXL2ABATTAAR1CA1
SCHEMBL1304591 0.76
Fluoride Ion SCHEMBL1694379 0.76 ALDH1A1 (0.42) LTA4H
Hydrochloric Acid SCHEMBL9445131 0.76 ALDH1A1 (0.42) LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3820629-A1 PROCESS FOR FORMING A POLYMERIC ORGANIC FILM AT THE SURFACE OF A METAL SUBSTRATE USING A GEL Commissariat à l'énergie atomique et aux énergies alternatives (FR) 2021-05-19 EP claimed
EP-3077127-B1 ADHESION PRIMER FOR PAINT COMMISSARIAT ENERGIE ATOMIQUE (FR) 2018-11-14 EP claimed
EP-3077127-A1 ADHESION PRIMER FOR PAINT Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR) 2016-10-12 EP claimed
EP-3891229-B1 PROCESS FOR PREPARING A SURFACE WITH BACTERIOSTATIC ACTIVITY AND SURFACE THUS PREPARED COMMISSARIAT ENERGIE ATOMIQUE (FR) 2024-03-27 EP disclosed
EP-3891229-A1 PROCESS FOR PREPARING A SURFACE WITH BACTERIOSTATIC ACTIVITY AND SURFACE THUS PREPARED Commissariat à l'énergie atomique et aux énergies alternatives (FR) 2021-10-13 EP disclosed
EP-3864191-A1 METHOD FOR TREATING A SPECIFIC METAL PART TO ENHANCE THE CORROSION RESISTANCE THEREOF AND THE ADHESION PROPERTIES THEREOF WITH RESPECT TO A COATING COMPOSITION SUCH AS A PAINT Commissariat à l'énergie atomique et aux énergies alternatives (FR) 2021-08-18 EP disclosed
EP-3820629-A1 PROCESS FOR FORMING A POLYMERIC ORGANIC FILM AT THE SURFACE OF A METAL SUBSTRATE USING A GEL Commissariat à l'énergie atomique et aux énergies alternatives (FR) 2021-05-19 EP disclosed
WO-2020115434-A1 PROCESS FOR PREPARING A SURFACE WITH BACTERIOSTATIC ACTIVITY AND SURFACE THUS PREPARED COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2020-06-11 WO disclosed
WO-2020109724-A1 METHOD FOR TREATING A SPECIFIC METAL PART TO ENHANCE THE CORROSION RESISTANCE THEREOF AND THE ADHESION PROPERTIES THEREOF WITH RESPECT TO A COATING COMPOSITION SUCH AS A PAINT COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2020-06-04 WO disclosed
CN-110225933-A Aqueous polyurethane resin combination 株式会社艾迪科 2019-09-10 CN disclosed
CN-110114376-A Curable composition, method for producing cured product, cured product thereof, and adhesive using same 株式会社ADEKA 2019-08-09 CN disclosed
WO-2011077052-A1 METHOD FOR TREATING THE ELASTOMER SURFACE OF A DEVICE FOR DISPENSING A FLUID PRODUCT VALOIS SAS (FR) 2011-06-30 WO disclosed
WO-2011077056-A1 METHOD FOR TREATING THE SURFACE OF A DEVICE FOR DISPENSING A FLUID PRODUCT VALOIS SAS (FR) 2011-06-30 WO disclosed
WO-2011077049-A1 METHOD FOR TREATING THE SURFACE OF A DEVICE FOR DISPENSING A FLUID PRODUCT VALOIS SAS (FR) 2011-06-30 WO disclosed
WO-2011077055-A1 METHOD FOR TREATING THE SURFACE OF A DEVICE FOR DISPENSING A FLUID PRODUCT VALOIS SAS (FR) 2011-06-30 WO disclosed
WO-2011073363-A1 CATION EXCHANGE MEMBRANE HAVING ENHANCED SELECTIVITY, METHOD FOR PREPARING SAME, AND USES THEREOF Commissariat à l'énergie atomique et aux énergies alternatives (FR) 2011-06-23 WO disclosed
WO-2010125190-A1 METHOD FOR PREPARING AN ORGANIC FILM AT THE SURFACE OF A SOLID SUBSTRATE WITH OXIDIZING PROCESSING Commissariat à l'énergie atomique et aux énergies alternatives (FR) 2010-11-04 WO disclosed
WO-2010034840-A1 CHEMICAL SENSORS CONTAINING CARBON NANOTUBES, METHOD FOR MAKING SAME, AND USES THEREOF COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2010-04-01 WO disclosed
EP-1750859-A2 PATTERNING CARBON NANOTUBE COATINGS BY SELECTIVE CHEMICAL MODIFICATION Elkos, Inc. (US) 2007-02-14 EP disclosed
WO-2006078286-A2 PATTERNING CARBON NANOTUBE COATINGS BY SELECTIVE CHEMICAL MODIFICATION EIKOS, INC. (US) 2006-07-27 WO disclosed