SCHEMBL589357

SCHEMBL589357

COS(=O)(=O)[O-].C[N+](OCCO)(OCCO)OCCO

nearest known ligand 0.33

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
USP2 O75604 1/20 0.31
TSHR P16473 1/20 0.31
GALR3 O60755 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL6679420 0.88 POLB (0.33) POLBUSP2TSHR
Sulfuric Acid SCHEMBL5039820 0.87 MEN1 (0.35) TSHRGALR3
SCHEMBL27903576 0.85 USP2 (0.32) USP2TSHR
SCHEMBL6310749 0.82 RECQL (0.36) TSHR
Sulfuric Acid SCHEMBL27564936 0.82 ALDH1A1 (0.31) TSHRGALR3
SCHEMBL638342 0.79 TSHR (0.39) TSHRGALR3
SCHEMBL27772076 0.78 BBOX1 (0.30)
Hydrochloric Acid SCHEMBL2444153 0.77 CYP3A4 (0.38) TSHRGALR3
Bromide SCHEMBL28550756 0.77 MEN1 (0.38) TSHRGALR3
Fluoride Ion SCHEMBL190628 0.77 TSHR (0.37) TSHRGALR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115175967-A Ionic liquids for stabilizing viscosity of silicate-based coatings 巴斯夫欧洲公司 2022-10-11 CN claimed
EP-0798267-B1 Organoclay compositions manufactured with organic acid ester-derived quaternary ammonium compounds, their preparation and non-aqueous fluid systems containing such compositions RHEOX INT (US) 2002-06-26 EP claimed
US-5718841-A Organoclay compositions manufactured with organic acid derived ester quaternary ammonium compounds RHEOX, INC. (US) 1998-02-17 US claimed
EP-0798267-A1 Organoclay compositions manufactured with organic acid ester-derived quaternary ammonium compounds, their preparation and non-aqueous fluid systems containing such compositions RHEOX INTERNATIONAL, INC. (US) 1997-10-01 EP claimed
CN-117858859-A Reaction process for preparing nitrogen-containing phosphoryl compounds as in-situ fluid compositions 加里·戴维·麦克奈特 2024-04-09 CN disclosed
EP-4291543-A1 REACTION METHODS FOR PRODUCING NITROGENOUS PHOSPHORYL COMPOUNDS THAT ARE IN SITU FLUID COMPOSITIONS Mcknight, Gary, David (US) 2023-12-20 EP disclosed
US-20230140913-A1 REACTION METHODS FOR PRODUCING NITROGENOUS PHOSPHORYL COMPOUNDS THAT ARE IN SITU FLUID COMPOSITIONS SOILGENIC TECHNOLOGIES, LLC 2023-05-11 US disclosed
CN-115175967-A Ionic liquids for stabilizing viscosity of silicate-based coatings 巴斯夫欧洲公司 2022-10-11 CN disclosed
WO-2022197751-A1 REACTION METHODS FOR PRODUCING NITROGENOUS PHOSPHORYL COMPOUNDS THAT ARE IN SITU FLUID COMPOSITIONS MCKNIGHT GARY DAVID (US) 2022-09-22 WO disclosed
CN-107075414-B Fabric softener active compositions 赢创德固赛有限公司 2020-01-10 CN disclosed
US-10301574-B2 Fabric enhancer composition THE PROCTER & GAMBLE COMPANY (US) 2019-05-28 US disclosed
EP-3204475-B1 FABRIC SOFTENER ACTIVE COMPOSITION EVONIK DEGUSSA GMBH (DE) 2018-12-12 EP disclosed
WO-2004033611-A1 GRANULAR COMPOSITION FOR ANTI-SPOTTING LAUNDRY DETERGENT CJ CORPORATION (KR) 2004-04-22 WO disclosed
WO-2004024860-A1 COMPLEX SALT FOR ANTI-SPOTTING DETERGENTS CJ CORPORATION (KR) 2004-03-25 WO disclosed
WO-2004024779-A2 MULTI-PURPOSE CATIONIC AND ASSOCIATIVE POLYMERS AND COMPOSITIONS CONTAINING THEM AND THEIR METHOD OF PREPARATION NOVEON IP HOLDINGS CORP. (US) 2004-03-25 WO disclosed
US-20040048764-A1 Complex salt for anti-spotting detergents CJ CORP. (KR) 2004-03-11 US disclosed
CN-1358226-A Concentrated perfume compositions and production of fabric softening compositions therefrom UNILEVER PLC (NL) 2002-07-10 CN disclosed
EP-0798267-B1 Organoclay compositions manufactured with organic acid ester-derived quaternary ammonium compounds, their preparation and non-aqueous fluid systems containing such compositions RHEOX INT (US) 2002-06-26 EP disclosed
US-5718841-A Organoclay compositions manufactured with organic acid derived ester quaternary ammonium compounds RHEOX, INC. (US) 1998-02-17 US disclosed
EP-0798267-A1 Organoclay compositions manufactured with organic acid ester-derived quaternary ammonium compounds, their preparation and non-aqueous fluid systems containing such compositions RHEOX INTERNATIONAL, INC. (US) 1997-10-01 EP disclosed