SCHEMBL802214

SCHEMBL802214

Cn1cc(C(C)(C)C)c(C(F)F)n1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL12731902 0.88
SCHEMBL13868030 0.82
SCHEMBL17997478 0.82 PAK4 (0.33)
SCHEMBL15292260 0.80
SCHEMBL18427033 0.77
SCHEMBL16661427 0.73 PAK4 (0.30)
SCHEMBL2325696 0.72 ALDH1A1 (0.31)
SCHEMBL21719963 0.72
SCHEMBL16373265 0.71 ALDH1A1 (0.33)
SCHEMBL21224645 0.71 IRAK4 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230065217-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS AND METHODS ESCIENT PHARMACEUTICALS, INC. 2023-03-02 US disclosed
US-9556205-B2 Fungicide N-[(trisubstitutedsilyl)methyl]-carboxamide derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2017-01-31 US disclosed
US-9556205-B2 Fungicide N-[(trisubstitutedsilyl)methyl]-carboxamide derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2017-01-31 US disclosed
US-9320277-B2 Fungicide N-cycloalkyl-N-biphenylmethyl-carboxamide derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-04-26 US disclosed
US-20160023987-A1 BENZOCYCLOALKENES AS ANTIFUNGAL AGENTS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-01-28 US disclosed
US-9173399-B2 Benzocycloalkenes as antifungal agents BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-11-03 US disclosed
US-8927581-B2 Fungicidal N-(2-pyridylpropyl) carboxamide derivatives and their oxa, aza and thia analogues BAYER CROPSCIENCE AG (DE) 2015-01-06 US disclosed
US-8841332-B2 Fungicidal N-(2-phenoxyethyl)carboxamide derivatives and their aza, thia and sila analogues BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-09-23 US disclosed
US-20140171474-A1 FUNGICIDE N-CYCLOALKYL-N-BIPHENYLMETHYL-CARBOXAMIDE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH 2014-06-19 US disclosed
US-8680127-B2 Fungicide N-cycloalkyl-N-biphenylmethyl-carboxamide derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-03-25 US disclosed
US-7932283-B2 Fungicide N-cyclopropyl-sulfonylamide derivatives BAYER CROPSCIENCE AG (DE) 2011-04-26 US disclosed
US-20110046152-A1 Amide Compounds, Preparation Methods and Uses Thereof SINOCHEM CORPORATION 2011-02-24 US disclosed
US-20100144817-A1 FUNGICIDEL N-CYCLOALKYL-BENZYL-THIOCARBOXAMIDES OR N-CYCLOALKYL-BENZYL-N'-SUBSTITUTED-AMIDINE DERIVATIVES BAYER SAS (FR) 2010-06-10 US disclosed
US-20100144817-A1 FUNGICIDEL N-CYCLOALKYL-BENZYL-THIOCARBOXAMIDES OR N-CYCLOALKYL-BENZYL-N'-SUBSTITUTED-AMIDINE DERIVATIVES BAYER SAS (FR) 2010-06-10 US disclosed
US-20100130560-A1 FUNGICIDE 2-PYRIDYL-METHYLENE-THIO CARBOXAMIDE OR 2-PYRIDYL-METHYLENE-N-SUBSTITUTED CARBOXIMIDAMIDE DERIVATIVES BAYER SAS (FR) 2010-05-27 US disclosed
US-20100010048-A1 Fungicide 2-pyridyl-methylene-carboxamide derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2010-01-14 US disclosed
US-20090326016-A1 FUNGICIDAL N-CYCLOALKYL-CARBOXAMIDE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2009-12-31 US disclosed
US-20090326016-A1 FUNGICIDAL N-CYCLOALKYL-CARBOXAMIDE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2009-12-31 US disclosed
US-20090137611-A1 Fungicide N-Cyclopropyl-Sulfonylamide Derivatives BAYER CROPSCIENCE AG (DE) 2009-05-28 US disclosed
US-20090137611-A1 Fungicide N-Cyclopropyl-Sulfonylamide Derivatives BAYER CROPSCIENCE AG (DE) 2009-05-28 US disclosed