SCHEMBL738255

SCHEMBL738255

Brc1nc[c]s1

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
SCHEMBL5012166 0.67
SCHEMBL449021 0.54
SCHEMBL690409 0.45
SCHEMBL423198 0.45
SCHEMBL5162 0.43
SCHEMBL24617 0.35
Calcium Bromide SCHEMBL30888723 0.34
Perbromobenzene SCHEMBL27124 0.34 ALDH1A1 (0.50)
SCHEMBL284725 0.29
Methane SCHEMBL23044967 0.25

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110092788-B Substituted [1,2,4] triazolo [1,5-a ] pyrimidin-7-yl compounds as PDE2 inhibitors 达特神经科学(开曼)有限公司 2022-02-25 CN claimed
EP-3597649-B1 COMPOSITIONS CONTAINING SUBSTITUTED [1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL COMPOUNDS AS PDE2 INHIBITORS DART NEUROSCIENCE CAYMAN LTD (KY) 2021-10-13 EP claimed
EP-3134413-B1 SUBSTITUTED [1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL COMPOUNDS AS PDE2 INHIBITORS DART NEUROSCIENCE CAYMAN LTD (KY) 2019-09-11 EP claimed
US-9932345-B2 Substituted [1,2,4]triazolo[1,5-A]pyrimidin-7-yl compounds as PDE2 inhibitors DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2018-04-03 US claimed
US-20170057967-A1 SUBSTITUTED [1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL COMPOUNDS AS PDE2 INHIBITORS DART NEUROSCIENCE LLC 2017-03-02 US claimed
EP-3134413-A1 SUBSTITUTED [1,2,4]TRIAZOLO [1,5-A]PYRIMIDIN-7-YL COMPOUNDS AS PDE2 INHIBITORS Dart Neuroscience (Cayman) Ltd (KY) 2017-03-01 EP claimed
EP-2049488-B1 N'-CYANO-N-ALKYL HALIDE IMIDE AMIDE DERIVATIVES BAYER IP GMBH (DE) 2015-12-09 EP claimed
WO-2015164508-A1 SUBSTITUTED [1,2,4] TRIAZOLO [1,5-A] PYRIMIDIN-7-YL COMPOUNDS AS PDE2 INHIBITORS DART NEUROSCIENCE, LLC (US) 2015-10-29 WO claimed
US-20140113824-A1 BICYCLIC (THIO)CARBONYLAMIDINES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-04-24 US claimed
EP-2021344-B1 BICYCLIC ENAMINO(THIO)CARBONYL COMPOUNDS BAYER CROPSCIENCE AG (DE) 2013-05-08 EP claimed
CN-1245854-A Processed timber SUMITOMO CHEMICAL CO (JP) 2000-03-01 CN claimed
EP-0976328-A2 Ectoparasite controlling agent for animals SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-02 EP claimed
EP-0966961-A1 Method for controlling ectoparasites SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-29 EP claimed
EP-0366085-B1 Tetrahydropyrimidines, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1996-04-17 EP claimed
EP-0496106-B1 Stable agrochemical compositions TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-12-20 EP claimed
EP-0496106-A1 Stable agrochemical compositions Takeda Chemical Industries, Ltd. (JP) 1992-07-29 EP claimed
CN-1063014-A Stable composition pesticide TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1992-07-29 CN claimed
US-4427688-A N-Substituted 2-methylnaphthylamides, their preparation, and their use for controlling fungi BASF AKTIENGESELLSCHAFT (DE) 1984-01-24 US claimed
EP-0073973-A1 Thiazolyl and isothiazolyl-carboxylic-acid anilides, process for their preparation and their utilization as fungicides BASF Aktiengesellschaft (DE) 1983-03-16 EP claimed
EP-0065723-A1 N-substituted 2-methylnaphthyl amides, their preparation and their use as fungicides BASF Aktiengesellschaft (DE) 1982-12-01 EP claimed