SCHEMBL3552282

SCHEMBL3552282

[CH2]C(C)(C)C=CC

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
SCHEMBL3552281 1.00
SCHEMBL1193342 0.73
SCHEMBL19782 0.73
SCHEMBL28909431 0.70
SCHEMBL645451 0.70
SCHEMBL1760723 0.70
SCHEMBL1652971 0.70
SCHEMBL20684795 0.69
SCHEMBL29220335 0.69
SCHEMBL276356 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0457139-B1 Process for the preparation of N-substituted imidazoles BASF AG (DE) 1996-01-24 EP claimed
CN-107949625-B Hydrocarbon soluble/dispersible hemiformals as hydrogen sulfide scavengers 艺康美国股份有限公司 2020-10-02 CN disclosed
EP-3347441-B1 HYDROCARBON SOLUBLE/DISPERSIBLE HEMIFORMALS AS HYDROGEN SULFIDE SCAVENGERS ECOLAB USA INC (US) 2020-06-10 EP disclosed
US-10407626-B2 Hydrocarbon soluble/dispersible hemiformals as hydrogen sulfide scavengers ECOLAB USA INC. (US) 2019-09-10 US disclosed
EP-3347441-A1 HYDROCARBON SOLUBLE/DISPERSIBLE HEMIFORMALS AS HYDROGEN SULFIDE SCAVENGERS Ecolab USA Inc. (US) 2018-07-18 EP disclosed
WO-2017044250-A1 HYDROCARBON SOLUBLE/DISPERSIBLE HEMIFORMALS AS HYDROGEN SULFIDE SCAVENGERS ECOLAB USA INC. (US) 2017-03-16 WO disclosed
US-20170066977-A1 HYDROCARBON SOLUBLE/DISPERSIBLE HEMIFORMALS AS HYDROGEN SULFIDE SCAVENGERS ECOLAB USA INC. (US) 2017-03-09 US disclosed
US-9233111-B2 Pyrrolo pyrimidine derivatives NOVARTIS AG (CH) 2016-01-12 US disclosed
US-20150344404-A1 PDK4 INHIBITOR AND USE THEREOF THE KITASATO INSTITUTE (JP) 2015-12-03 US disclosed
US-9181244-B1 Substituted pyrido[2,3-c]pyridazin-4(1H)-ones as tumor necrosis factor alpha and phosphodiesterase 4 inhibitors Xuanzhu Pharma Co., Ltd. (CN) 2015-11-10 US disclosed
US-5266171-A Electrochemical oxidation in and etherification BASF AKTIENGESELLSCHAFT (DE) 1993-11-30 US disclosed
US-5210214-A Polar Solvents BASF AKTIENGESELLSCHAFT (DE) 1993-05-11 US disclosed
US-5179210-A PREPARATION OF N-SUBSTITUTED IMIDAZOLES BASF AKTIENGESELLSCHAFT (DE) 1993-01-12 US disclosed
EP-0509301-A1 Process for preparing indolenines BASF Aktiengesellschaft (DE) 1992-10-21 EP disclosed
EP-0460451-A1 Process for the preparation of alpha-hydroxymethyl-ketals BASF Aktiengesellschaft (DE) 1991-12-11 EP disclosed
EP-0457139-A2 Process for the preparation of N-substituted imidazoles BASF Aktiengesellschaft (DE) 1991-11-21 EP disclosed
US-4914116-A Nitrogen-containing heterocyclic compounds, and their use as insecticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-04-03 US disclosed
US-4847259-A Nitrogen-containing heterocyclic compounds, and use as insecticide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-07-11 US disclosed
US-4714706-A JUVENILE HORMONE INHIBITORS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-12-22 US disclosed
EP-0203798-A2 Nitrogen-containing heterocyclic compounds, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-12-03 EP disclosed