SCHEMBL2831232

SCHEMBL2831232

[CH2]CC(C)[N+](=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
SCHEMBL2800896 0.78
SCHEMBL7753021 0.73
SCHEMBL267194 0.73
SCHEMBL66582 0.71
SCHEMBL11780986 0.71
SCHEMBL524448 0.71
SCHEMBL9865498 0.71
SCHEMBL9865504 0.71
SCHEMBL10893121 0.71
SCHEMBL1123161 0.71 ALDH1A1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230125434-A1 METHOD FOR PRODUCING MONOSULFOXIDE DERIVATIVE KUMIAI CHEMICAL INDUSTRY CO. LTD. (JP) 2023-04-27 US disclosed
EP-4144723-A1 METHOD FOR PRODUCING MONOSULFOXIDE DERIVATIVE Kumiai Chemical Industry Co., Ltd. (JP) 2023-03-08 EP disclosed
CN-115461324-A Process for producing monosulfoxide derivative 组合化学工业株式会社 2022-12-09 CN disclosed
EP-3424903-B1 METHOD FOR PRODUCING SULFOXIDE DERIVATIVE KUMIAI CHEMICAL INDUSTRY CO (JP) 2021-09-29 EP disclosed
CN-108779067-B Process for producing sulfoxide derivative 组合化学工业株式会社 2020-07-14 CN disclosed
US-10577313-B2 Method for producing sulfoxide derivative KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2020-03-03 US disclosed
EP-3424903-A1 METHOD FOR PRODUCING SULFOXIDE DERIVATIVE Kumiai Chemical Industry Co., Ltd. (JP) 2019-01-09 EP disclosed
CN-108779067-A The preparation method of sulfoxide derivant 组合化学工业株式会社 2018-11-09 CN disclosed
CN-103788868-A Hydrophilic compositions, methods for their production, and substrates coated with such compositions PPG IND OHIO INC 2014-05-14 CN disclosed
CN-103275615-A Hydrophilic compositions, methods for their production, and substrates coated with such compositions PPG IND OHIO INC 2013-09-04 CN disclosed
WO-1995018792-A1 PYRROLIDINE-CONTAINING MONOMERS AND OLIGOMERS ISIS PHARMACEUTICALS, INC. (US) 1995-07-13 WO disclosed
WO-1995018623-A1 OLIGOMERIC COMPOUNDS HAVING NITROGEN-CONTAINING LINKAGES ISIS PHARMACEUTICALS, INC. (US) 1995-07-13 WO disclosed
EP-0651759-A1 NOVEL 2'-O-ALKYL NUCLEOSIDES AND PHOSPHORAMIDITES PROCESSES FOR THE PREPARATION AND USES THEREOF ISIS PHARMACEUTICALS, INC. (US) 1995-05-10 EP disclosed
EP-0635023-A1 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1995-01-25 EP disclosed
WO-1994002501-A1 NOVEL 2'-O-ALKYL NUCLEOSIDES AND PHOSPHORAMIDITES PROCESSES FOR THE PREPARATION AND USES THEREOF ISIS PHARMACEUTICALS, INC. (US) 1994-02-03 WO disclosed
WO-1993018052-A1 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1993-09-16 WO disclosed
US-4517003-A N-acyl phosphoric triamide urease inhibitors and urease inhibited urea based fertilizer compositions ALLIED CORPORATION (US) 1985-05-14 US disclosed
US-4086341-A NITRO SUBSTITUTED; ANTIBIOTIC BAYER AKTIENGESELLSCHAFT (DT) 1978-04-25 US disclosed
US-4029806-A Nitro-β-lactam antibiotics and processes for their preparation and use BAYER AKTIENGESELLSCHAFT (DT) 1977-06-14 US disclosed
US-4012518-A PENICILLIN DERIVATIVES AS GROWTH AND FEED UTILIZATION PROMOTERS IN ANIMALS BAYER AKTIENGESELLSCHAFT (DT) 1977-03-15 US disclosed