SCHEMBL491889

SCHEMBL491889

C1#C[CH]1

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
Benzene SCHEMBL28217851 0.45 TSHR (0.75)
SCHEMBL29889134 0.45
Benzene SCHEMBL5545977 0.45
SCHEMBL14985 0.45
Methane SCHEMBL22638773 0.45
SCHEMBL29633605 0.45
SCHEMBL29817629 0.45
SCHEMBL6559802 0.45
SCHEMBL5667029 0.45
SCHEMBL27950967 0.45

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580795-B2 Heterocyclic compounds as phosphodiesterase inhibitors ORCHID CHEMICALS & PHARMACEUTICALS LIMITED (IN) 2013-11-12 US claimed
US-20110269753-A1 HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS ORCHID RESEARCH LABORATORIES LTD. (IN) 2011-11-03 US claimed
EP-2379538-A2 HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS Orchid Research Laboratories Limited (IN) 2011-10-26 EP claimed
WO-2010084402-A2 HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS ORCHID RESEARCH LABORATORIES LTD. (IN) 2010-07-29 WO claimed
EP-0451168-B1 1-PHENYL-3-CARBOXYAMIDOPYRROLIDONES AND THEIR USE AS HERBICIDES ZENECA INC (US) 1994-06-15 EP claimed
CN-118290298-A Benzoyl hydrazine compound and synthetic method and application thereof 南京农业大学 2024-07-05 CN disclosed
EP-4205845-B1 SUPPORTED CATALYST AND SYNTHESIS METHOD FOR SUCROSE-6-ESTER ANHUI JINHE IND CO LTD (CN) 2024-07-03 EP disclosed
EP-4058450-B1 4-(4-(4,5-DIHYDROISOXAZOL-3-YL)THIAZOL-2-YL)PIPERIDINE SULFILIMINE AND SULFOXIMINE DERIVATIVES AND RELATED COMPOUNDS AS FUNGICIDES FOR CROP PROTECTION PI INDUSTRIES LTD (IN) 2024-07-03 EP disclosed
US-12024571-B2 Anti-erythropoietin receptor peptide EPO-MED INC. (JP) 2024-07-02 US disclosed
US-12024510-B2 Pyrazolopyridine-diamides, their use as insecticide and processes for preparing the same PI INDUSTRIES LTD. (IN) 2024-07-02 US disclosed
US-12024549-B2 Compound having affinity substance to soluble protein, cleavable portion and reactive group, or salt thereof AJINOMOTO CO., INC. (JP) 2024-07-02 US disclosed
CN-115710199-B Photooxidation reduction catalytic process 深圳湾实验室坪山生物医药研发转化中心 2024-06-28 CN disclosed
WO-2000063208-A1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-10-26 WO disclosed
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 EP disclosed
US-6054596-A Process for producing cyclic carbonic esters DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2000-04-25 US disclosed
EP-0926953-A4 HALOPROPARGYL INCLUSION COMPLEXES TROY CORP (US) 1999-10-13 EP disclosed
EP-0943612-A1 Process for producing cyclic carbonic esters Daicel Chemical Industries, Ltd. (JP) 1999-09-22 EP disclosed
EP-0926953-A1 HALOPROPARGYL INCLUSION COMPLEXES TROY CORPORATION (US) 1999-07-07 EP disclosed
US-5906981-A BIOCIDES AND CYCLODEXTRIN TROY CORPORATION (US) 1999-05-25 US disclosed
WO-1997046095-A1 HALOPROPARGYL INCLUSION COMPLEXES TROY CORPORATION (US) 1997-12-11 WO disclosed