SCHEMBL354385

SCHEMBL354385

CC=CC(C)(C)C(=O)O

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
SCHEMBL10250082 1.00
SCHEMBL11305817 1.00
SCHEMBL11385889 0.81 ALDH1A1 (0.35)
SCHEMBL1785110 0.77
SCHEMBL7761713 0.77 TSHR (0.40)
SCHEMBL6728883 0.77
SCHEMBL1785108 0.77
SCHEMBL6728878 0.77
SCHEMBL7759825 0.77 TSHR (0.40)
SCHEMBL16449145 0.77 TSHR (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114717280-A Synthesis method of monopilavir 浙江工业大学 2022-07-08 CN claimed
CN-116615411-A Process for producing peptide compound containing N-substituted amino acid residue 中外制药株式会社 2023-08-18 CN disclosed
CN-114717280-A Synthesis method of monopilavir 浙江工业大学 2022-07-08 CN disclosed
CN-114717280-A Synthesis method of monopilavir 浙江工业大学 2022-07-08 CN disclosed
CN-103739574-B A kind of synthetic method of 5H-furans-2-ketone compounds of replacement JIANG University OF TECHNOLOGY (CN) 2015-08-26 CN disclosed
US-20140329746-A1 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2014-11-06 US disclosed
US-8835654-B2 Method and compositions for treating amyloid-related diseases BHI LIMITED PARTNERSHIP (CA) 2014-09-16 US disclosed
EP-1642934-B1 TRANSPARENT RESIN COMPOSITION SANYO CHEMICAL IND LTD (JP) 2012-12-12 EP disclosed
US-20120015911-A1 METHOD AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES BELLUS HEALTH INC. (CA) 2012-01-19 US disclosed
US-8044100-B2 Methods and compositions for treating amyloid-related diseases BELLUS HEALTH INC. (CA) 2011-10-25 US disclosed
EP-0007089-B1 ACYLANILIDES WITH HERBICIDAL AND FUNGICIDAL ACTIVITY, PROCESS FOR THEIR PREPARATION AND THEIR USE Consortium für elektrochemische Industrie GmbH (DE) 1981-09-16 EP disclosed
US-4264456-A IN FABRIC SOFTENER INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1981-04-28 US disclosed
US-4259214-A PERFUME ADDITIVE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1981-03-31 US disclosed
US-4255275-A FOR SOLID OR LIQUID DETERGENTS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1981-03-10 US disclosed
US-4241097-A Use of benzodionones in augmenting or enhancing the aroma and taste of a foodstuff INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1980-12-23 US disclosed
EP-0007089-A1 Acylanilides with herbicidal and fungicidal activity, process for their preparation and their use Consortium für elektrochemische Industrie GmbH (DE) 1980-01-23 EP disclosed
US-4000327-A BERRY FRUIT FOODSTUFFS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-12-28 US disclosed
US-3984579-A Novel flavoring compositions and products containing isomer mixtures containing high proportions of 2-methyl-cis-3-pentenoic acid INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-10-05 US disclosed
US-3931306-A Process for producing isomer mixtures containing high proportions of cis-2-methyl-3-pentenoic acid INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-01-06 US disclosed
US-3931293-A Processes for producing cis alkyl-2-methyl-3-pentenoates and isomer mixtures containing high proportions of cis alkyl-2-methyl-3-pentenoates INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-01-06 US disclosed