SCHEMBL1828282

SCHEMBL1828282

C=CCn1cnnc1

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
SCHEMBL83887 0.69
SCHEMBL16371567 0.69 TBXAS1 (0.48)
SCHEMBL25464834 0.69 TSHR (0.35)
Iodide SCHEMBL534239 0.67
SCHEMBL16101937 0.67
Bromide SCHEMBL625730 0.67
Hydrochloric Acid SCHEMBL252185 0.67
SCHEMBL16101936 0.67
SCHEMBL9318 0.67
SCHEMBL22555800 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357578-A1 AIRTIGHT FILM WITH CERAMIC SEALING LAYER AND POLYMER SEALING LAYER Quantum MicroMaterials, Inc. 2023-11-09 US claimed
US-20160280691-A1 TRIAZOLE INTERMEDIATES USEFUL IN THE SYNTHESIS OF PROTECTED N-ALKYLTRIAZOLECARBALDEHYDES BIOMARIN PHARMACEUTICAL INC. 2016-09-29 US claimed
EP-3066084-A1 TRIAZOLE INTERMEDIATES USEFUL IN THE SYNTHESIS OF PROTECTED N-ALKYLTRIAZOLECARBALDEHYDES Medivation Technologies, Inc. (US) 2016-09-14 EP claimed
EP-2507252-B1 HEAT-SENSITIVE SPIN-TRANSITION MATERIALS DOPED WITH ONE OR MORE FLUORESCENT AGENTS CENTRE NAT RECH SCIENT (FR) 2016-02-17 EP claimed
WO-2015069851-A1 TRIAZOLE INTERMEDIATES USEFUL IN THE SYNTHESIS OF PROTECTED N-ALKYLTRIAZOLECARBALDEHYDES BIOMARIN PHARMACEUTICAL INC. (US) 2015-05-14 WO claimed
EP-2507252-A1 HEAT-SENSITIVE SPIN-TRANSITION MATERIALS DOPED WITH ONE OR MORE FLUORESCENT AGENTS Centre National De La Recherche Scientifique CNRS (FR) 2012-10-10 EP claimed
WO-2011058277-A1 HEAT-SENSITIVE SPIN-TRANSITION MATERIALS DOPED WITH ONE OR MORE FLUORESCENT AGENTS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2011-05-19 WO claimed
EP-0695362-B1 CHIRAL SYNTHESIS OF TERTIARY ALCOHOLS WITH A HYDROLASE ZENECA LTD (GB) 1999-08-18 EP claimed
US-20250066570-A1 LAMINATE DEVICE WITH METALLIC AND POLYMER LAYERS QUANTUM MICROMATERIALS INC (US) 2025-02-27 US disclosed
US-12077646-B2 Coating substrate by polymerization of amine compound and apparatus having polymer coated substrate Quantum MicroMaterials, Inc. (US) 2024-09-03 US disclosed
US-20240166678-A1 Transcriptome In Vivo Analysis (TIVA) and Transcriptome In Situ Analysis (TISA) THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2024-05-23 US disclosed
EP-3953360-B1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF MONOACYLGLYCEROL LIPASE (MAGL) HOFFMANN LA ROCHE (CH) 2024-02-28 EP disclosed
US-11873312-B2 Transcriptome in vivo analysis (TIVA) and transcriptome in situ analysis (TISA) THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2024-01-16 US disclosed
US-20230357578-A1 AIRTIGHT FILM WITH CERAMIC SEALING LAYER AND POLYMER SEALING LAYER Quantum MicroMaterials, Inc. 2023-11-09 US disclosed
EP-2507252-B1 HEAT-SENSITIVE SPIN-TRANSITION MATERIALS DOPED WITH ONE OR MORE FLUORESCENT AGENTS CENTRE NAT RECH SCIENT (FR) 2016-02-17 EP disclosed
WO-2015069851-A1 TRIAZOLE INTERMEDIATES USEFUL IN THE SYNTHESIS OF PROTECTED N-ALKYLTRIAZOLECARBALDEHYDES BIOMARIN PHARMACEUTICAL INC. (US) 2015-05-14 WO disclosed
EP-2507252-A1 HEAT-SENSITIVE SPIN-TRANSITION MATERIALS DOPED WITH ONE OR MORE FLUORESCENT AGENTS Centre National De La Recherche Scientifique CNRS (FR) 2012-10-10 EP disclosed
WO-2011058277-A1 HEAT-SENSITIVE SPIN-TRANSITION MATERIALS DOPED WITH ONE OR MORE FLUORESCENT AGENTS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 2011-05-19 WO disclosed
WO-2010047737-A2 ANTIMICROBIAL INDOLINE COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. (KY) 2010-04-29 WO disclosed
US-4271308-A FUNGICIDES ROHM AND HAAS COMPANY (US) 1981-06-02 US disclosed