SCHEMBL131687

SCHEMBL131687

C=CCC(C(=O)[O-])[N+](C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
ALPL P05186 1/20 0.44
ALPG P10696 1/20 0.44
SLC22A4 Q9H015 1/20 0.37
BBOX1 O75936 4/20 0.36
GAA P10253 1/20 0.34
CPA1 P15085 1/20 0.33
GRIK1 P39086 2/20 0.31
GRIK2 Q13002 2/20 0.31
SLC22A16 Q86VW1 1/20 0.30

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
Acetic Acid SCHEMBL5682314 0.94 POLB (0.44) POLBALPLALPGSLC22A4BBOX1
SCHEMBL17744952 0.76 ALPL (0.37) POLBALPLALPGSLC22A4BBOX1
SCHEMBL8613535 0.72 ALPL (0.37) POLBALPLALPGSLC22A4BBOX1
SCHEMBL4027750 0.72 POLB (0.40) POLBALPLALPGSLC22A4BBOX1
SCHEMBL1427298 0.72 POLB (0.50) POLBALPLALPGSLC22A4BBOX1
SCHEMBL254215 0.70 ALPL (0.35) POLBALPLALPGSLC22A4BBOX1
Hydrochloric Acid SCHEMBL25181737 0.70 POLB (0.48) POLBALPLALPGSLC22A4BBOX1
SCHEMBL631293 0.68 POLB (0.47) POLBALPLALPGSLC22A4BBOX1
SCHEMBL109859 0.68 TSHR (0.52) POLBALPLALPGSLC22A4BBOX1
SCHEMBL4961179 0.68 POLB (0.47) POLBALPLALPGSLC22A4BBOX1

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

Appears in 13217 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118344940-A Fabric liquid detergent composition with anti-redeposition, soil release and softening effects 纳爱斯浙江科技有限公司 2024-07-16 CN claimed
CN-116446218-B Efficient air filter paper and preparation method and application thereof 华南理工大学 2024-07-16 CN claimed
US-20240226631-A1 NONFLUORINATED AGENT FOR LIQUID VEHICLE SYSTEMS TYCO FIRE PRODUCTS LP (US) 2024-07-11 US claimed
EP-4256015-B1 A HARD SURFACE CLEANING COMPOSITION UNILEVER IP HOLDINGS B V (NL) 2024-07-10 EP claimed
CN-118302146-A Personal care compositions for cleansing skin 宝洁公司 2024-07-05 CN claimed
CN-118291115-A Preparation method of non-oxidative safe environment-friendly gel breaker system 大庆斯略油田科技有限公司 2024-07-05 CN claimed
US-20240217932-A1 PYRIDIUM ESTERS THE PROCTER AND GAMBLE COMPANY 2024-07-04 US claimed
US-12023397-B2 Scalp protection composition PATECH FINE CHEMICALS CO., LTD. (TW) 2024-07-02 US claimed
CN-118272668-A Hydrophobic eutectic solvent for separating nickel and cobalt ions and preparation method thereof 天津崇研科技有限公司 2024-07-02 CN claimed
CN-118236278-A Shampoo composition for reducing negative effects of sulfate surfactant 广州市高姿化妆品有限公司 2024-06-25 CN claimed
CN-87105144-A Dilutable viscous detergent composition and process for its preparation 1988-04-06 CN claimed
EP-0179583-A1 A system for enhancing the water dissolution rate and solubility of poorly soluble drugs MERCK & CO. INC. (US) 1986-04-30 EP claimed
EP-0137178-A2 Colouring shampoo Wella Aktiengesellschaft (DE) 1985-04-17 EP claimed
US-4425419-A Photosensitive composition HITACHI, LTD. (JP) 1984-01-10 US claimed
US-4407999-A PARAFFIN EMULSION AND AMINO OR PHENOLIC RESIN MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1983-10-04 US claimed
EP-0025553-B1 PHOTOSENSITIVE COMPOSITIONS Hitachi, Ltd. (JP) 1983-05-25 EP claimed
US-4347308-A A FLUORINE-CONTAINING 2-SULFOMETHYLSUCCINATE AS ANTISTATIC AGENT; ANIONIC SURFACTANTS; X-RAY AND COLOR FILMS FUJI PHOTO FILM CO., LTD. (JP) 1982-08-31 US claimed
EP-0025553-A2 Photosensitive compositions Hitachi, Ltd. (JP) 1981-03-25 EP claimed
US-3980769-A ANIONIC AND AMPHOTERIC SURFACTANTS L'OREAL (FR) 1976-09-14 US claimed
US-3953218-A Pigment dispersion PMS CONSOLIDATED (US) 1976-04-27 US claimed