SCHEMBL949551

SCHEMBL949551

CSc1c(C)cc(N(C)C(=O)O)cc1C

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
SCHEMBL10979495 0.79 ALDH1A1 (0.34)
SCHEMBL9427777 0.78 KMT2A (0.35)
SCHEMBL9391197 0.77 TAS1R3 (0.41)
SCHEMBL850907 0.76 ALDH1A1 (0.38)
SCHEMBL15947052 0.74 TSHR (0.41)
SCHEMBL11510161 0.73 ALDH1A1 (0.42)
SCHEMBL465570 0.73 TPMT (0.46)
SCHEMBL585950 0.72 ALDH1A1 (0.46)
SCHEMBL11786403 0.72 ALDH1A1 (0.37)
SCHEMBL26451872 0.71 TPMT (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1649750-A2 Synergistic insecticidal mixtures based on chloronicotinyl insecticides Bayer CropScience AG (DE) 2006-04-26 EP claimed
EP-1107666-B1 SNAIL BAIT BAYER AG (DE) 2002-11-06 EP claimed
EP-1107666-A1 SNAIL BAIT Bayer Aktiengesellschaft (DE) 2001-06-20 EP claimed
WO-2000011948-A1 SNAIL BAIT BAYER AKTIENGESELLSCHAFT (DE) 2000-03-09 WO claimed
EP-0068294-B1 A NEW ACARICIDAL COMPOSITION, PROCESSES FOR ITS PRODUCTION AND ITS USE A. Nattermann & Cie. GmbH (DE) 1985-12-18 EP claimed
US-4315017-A Triazole derivatives BASF AKTIENGESELLSCHAFT (DE) 1982-02-09 US claimed
US-20230086007-A1 USE OF DENATONIUM BENZOATE AS A SEED TREATMENT FOR CROPS AS BIRD AND/OR INSECT REPELLENT KWS SAAT SE & Co. KGaA (DE) 2023-03-23 US disclosed
EP-4088579-A1 COMPOSITION AND USE THEREOF AS A REPELLENT FOR PROTECTING SEEDS AGAINST BIRDS SeedForward GmbH (DE) 2022-11-16 EP disclosed
EP-4088578-A1 COMPOSITION AND USE THEREOF AS A REPELLENT FOR PROTECTING SEEDS AGAINST BIRDS SeedForward GmbH (DE) 2022-11-16 EP disclosed
CN-111246741-B Active ingredient combinations having insecticidal/acaricidal properties 拜耳公司 2022-08-02 CN disclosed
EP-2854527-A1 STORAGE AIDS COMPRISING PLANT PROTECTANTS AND THEIR USE se ma Gesellschaft für Innovationen mbH (DE) 2015-04-08 EP disclosed
EP-1989209-B1 Aza-thia-benzazulene derivatives and pharmaceutical use thereof NOVARTIS TIERGESUNDHEIT AG (CH) 2015-03-25 EP disclosed
US-8932613-B2 Ectoparasite control method E I DU PONT DE NEMOURS AND COMPANY (US) 2015-01-13 US disclosed
US-3940412-A 2,4,5-Trichloro- and 2,4,5-tribromoimidazole derivatives and pesticidal compositions containing them CIBA-GEIGY AG (CH) 1976-02-24 US disclosed
US-3935224-A 4H-Pyrido[3,2a]-1,3,2-dioxophosphorane derivatives CIBA-GEIGY CORPORATION (US) 1976-01-27 US disclosed
US-3934010-A MITICIDE CIBA-GEIGY CORPORATION (US) 1976-01-20 US disclosed
US-3933945-A O-ethyl-S-(n)propyl-S-diallylcarbmoylmethyldithiophosphate CIBA-GEIGY CORPORATION (US) 1976-01-20 US disclosed
US-3932629-A Triazolyl phosphorus esters as pesticides CIBA-GEIGY CORPORATION (US) 1976-01-13 US disclosed
US-3932630-A Triazolyl phosphorus esters as pesticides CIBA-GEIGY CORPORATION (US) 1976-01-13 US disclosed
US-3932632-A Insecticidal compositions containing an organophosphorus compound and a thiolcarbamate BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-01-13 US disclosed