SCHEMBL1702472

SCHEMBL1702472

CCCCCCCCCCc1[nH]cc[n+]1C.F[B-](F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.36
GPR84 Q9NQS5 1/20 0.36
CHRM2 P08172 2/20 0.32
ADRA2A P08913 2/20 0.32
ADORA3 P0DMS8 2/20 0.32
CHRM1 P11229 2/20 0.32
ACHE P22303 2/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
ABCB11 O95342 1/20 0.32
ESR1 P03372 1/20 0.32
PGR P06401 1/20 0.32
HTR1A P08908 1/20 0.32
DRD1 P21728 1/20 0.32
TBXA2R P21731 1/20 0.32
PTGS1 P23219 1/20 0.32
PDE4A P27815 1/20 0.32
ADRA1A P35348 1/20 0.32
OPRM1 P35372 1/20 0.32

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
SCHEMBL6024612 1.00 KCNH2 (0.36) KCNH2GPR84CHRM2ADRA2AADORA3
SCHEMBL379050 1.00 KCNH2 (0.36) KCNH2GPR84CHRM2ADRA2AADORA3
SCHEMBL15287252 1.00 KCNH2 (0.36) KCNH2GPR84CHRM2ADRA2AADORA3
SCHEMBL17317397 1.00 KCNH2 (0.36) KCNH2GPR84CHRM2ADRA2AADORA3
SCHEMBL5186038 1.00 KCNH2 (0.36) KCNH2GPR84CHRM2ADRA2AADORA3
SCHEMBL15287066 1.00 KCNH2 (0.36) KCNH2GPR84CHRM2ADRA2AADORA3
SCHEMBL194361 1.00 KCNH2 (0.36) KCNH2GPR84CHRM2ADRA2AADORA3
SCHEMBL6023619 1.00 KCNH2 (0.36) KCNH2GPR84CHRM2ADRA2AADORA3
SCHEMBL2029175 1.00 KCNH2 (0.36) KCNH2GPR84CHRM2ADRA2AADORA3
SCHEMBL15287326 0.98 KCNH2 (0.33) KCNH2GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2964725-A1 COMPOSITIONS AND METHODS FOR SELECTIVELY ETCHING TITANIUM NITRIDE Advanced Technology Materials, Inc. (US) 2016-01-13 EP claimed
WO-2014138064-A1 COMPOSITIONS AND METHODS FOR SELECTIVELY ETCHING TITANIUM NITRIDE ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2014-09-12 WO claimed
EP-2583096-A1 METHOD FOR DETECTING PEROXIDE EXPLOSIVES Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2013-04-24 EP claimed
EP-2443078-A2 ODOR SAMPLES OF PEROXIDIC EXPLOSIVES Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2012-04-25 EP claimed
WO-2011157801-A1 METHOD FOR DETECTING PEROXIDE EXPLOSIVES Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2011-12-22 WO claimed
WO-2010146170-A2 ODOR SAMPLES OF PEROXIDIC EXPLOSIVES Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2010-12-23 WO claimed
WO-2024102900-A1 METHODS OF MAKING SHAPE STABLE PHASE CHANGE MATERIAL COMPOSITIONS PHASE CHANGE ENERGY SOLUTIONS, INC. (US) 2024-05-16 WO disclosed
WO-2024081696-A2 COMPOSITIONS CONTAINING PHASE CHANGE MATERIALS, METHODS FOR FORMING OBJECTS USING THE SAME, AND METHOD FOR USING THE SAME PHASE CHANGE ENERGY SOLUTIONS, INC. (US) 2024-04-18 WO disclosed
EP-4323491-A1 CLEANING COMPOSITION Entegris, Inc. (US) 2024-02-21 EP disclosed
EP-4271765-A1 SELECTIVE REMOVAL OF METAL OXIDE HARD MASKS Entegris, Inc. (US) 2023-11-08 EP disclosed
WO-2022221497-A1 CLEANING COMPOSITION ENTEGRIS, INC. (US) 2022-10-20 WO disclosed
WO-2022146846-A1 SELECTIVE REMOVAL OF METAL OXIDE HARD MASKS ENTEGRIS, INC. (US) 2022-07-07 WO disclosed
EP-3921400-A1 CERIA REMOVAL COMPOSITIONS Entegris, Inc. (US) 2021-12-15 EP disclosed
EP-2443078-A2 ODOR SAMPLES OF PEROXIDIC EXPLOSIVES Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2012-04-25 EP disclosed
WO-2011163640-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. (US) 2011-12-29 WO disclosed
WO-2011157801-A1 METHOD FOR DETECTING PEROXIDE EXPLOSIVES Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2011-12-22 WO disclosed
EP-2381778-A1 C5AR ANTAGONISTS ChemoCentryx, Inc. (US) 2011-11-02 EP disclosed
WO-2010146170-A2 ODOR SAMPLES OF PEROXIDIC EXPLOSIVES Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2010-12-23 WO disclosed
WO-2010075257-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. (US) 2010-07-01 WO disclosed
WO-2007051062-A2 SUBSTITUTED DIHYDROPYRIDINES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-05-03 WO disclosed