SCHEMBL109859

SCHEMBL109859

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
CYP3A4 P08684 2/20 0.52
NFKB1 P19838 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
POLB P06746 2/20 0.47
ALPL P05186 1/20 0.47
ALPG P10696 1/20 0.47
BBOX1 O75936 3/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.39
SLC22A4 Q9H015 1/20 0.39
HDAC1 Q13547 3/20 0.37
HDAC2 Q92769 3/20 0.37
CHRM1 P11229 1/20 0.37
AKR1A1 P14550 1/20 0.37
CHRM3 P20309 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
ADRA1A P35348 1/20 0.37
HRH1 P35367 1/20 0.37

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
SCHEMBL17763259 0.86 CA2 (0.50) TSHRCYP3A4NFKB1NPSR1POLB
SCHEMBL4894577 0.85 CA1 (0.55) TSHRCYP3A4NFKB1NPSR1POLB
SCHEMBL7259121 0.83 CA2 (0.55) NFKB1POLBALPLALPGCA1
SCHEMBL118864 0.83 CA2 (0.55) NFKB1POLBALPLALPGCA1
SCHEMBL43306 0.83 CA2 (0.55) NFKB1POLBALPLALPGCA1
SCHEMBL17763261 0.83 CA2 (0.55) NFKB1POLBALPLALPGCA1
SCHEMBL17763250 0.83 CA2 (0.55) NFKB1POLBALPLALPGCA1
SCHEMBL17763256 0.83 CA2 (0.55) NFKB1POLBALPLALPGCA1
SCHEMBL120131 0.83 CA2 (0.55) NFKB1POLBALPLALPGCA1
SCHEMBL117777 0.83 CA2 (0.55) NFKB1POLBALPLALPGCA1

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 10759 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118340682-A Efficacy composition suitable for swimming washing and caring products 润本生物技术股份有限公司 2024-07-16 CN claimed
EP-4396314-A1 HOME CARE COMPOSITIONS Colgate-Palmolive Company (US) 2024-07-10 EP claimed
EP-4392522-A1 A CONCENTRATED CLEANING COMPOSITION Unilever IP Holdings B.V. (NL) 2024-07-03 EP claimed
EP-4392523-A1 CLEANING COMPOSITIONS COMPRISING SODIUM LAURETH SULFATE AND LESS THAN 1 PPM 1,4-DIOXANE Colgate-Palmolive Company (US) 2024-07-03 EP claimed
CN-115433392-B Composite auxiliary agent for enhancing durability of polyolefin and application thereof 上海齐润新材料有限公司 2024-06-21 CN claimed
CN-118185709-A Process for preparing detergent granules 宝洁公司 2024-06-14 CN claimed
CN-114869828-B Pet deodorizing composition and application thereof 广州禾力生物科技有限公司 2024-05-07 CN claimed
CN-116725892-B Composition capable of regulating skin flora balance, controlling oil and preserving moisture and application thereof 广州玥颜化妆品有限公司 2024-04-26 CN claimed
CN-117815087-A Transparent facial cleanser containing sodium lauroyl methylaminopropionate and preparation method thereof 广东职业技术学院 2024-04-05 CN claimed
WO-2024068248-A1 A SOLID CLEANING AND DISINFECTION COMPOSITION UNILEVER IP HOLDINGS B.V. (NL) 2024-04-04 WO claimed
US-5061383-A NONTOXIC FIRE SUPPRESSANT FRILOUX EDWARD E (US) 1991-10-29 US claimed
WO-1991015185-A1 HAIR STYLING SHAMPOOS THE PROCTER & GAMBLE COMPANY (US) 1991-10-17 WO claimed
EP-0137178-B1 COLOURING SHAMPOO Wella Aktiengesellschaft (DE) 1990-05-23 EP claimed
US-4832872-A ANIONIC, CATIONIC AND AMPHOTERIC SURFACTANT BLENDS RICHARDSON-VICKS INC. (US) 1989-05-23 US claimed
US-4772424-A Shampoo containing mixtures of sulfate and/or sulfonate, sarcosinate and betaine surfactants THE PROCTOR & GAMBLE COMPANY (US) 1988-09-20 US claimed
EP-0277876-A2 Composition for washing and conditioning hair in a single step LABORATOIRE LACHARTRE SOCIETE ANONYME: (FR) 1988-08-10 EP claimed
EP-0229690-A2 Cleaning compositions and method THE PROCTER & GAMBLE COMPANY (US) 1987-07-22 EP claimed
EP-0137178-A2 Colouring shampoo Wella Aktiengesellschaft (DE) 1985-04-17 EP claimed
WO-1985000110-A1 SMALL PARTICLE FORMATION OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1985-01-17 WO claimed
US-4383846-A WITH AMPHOTERIC SURFACTANT OCCIDENTAL RESEARCH CORPORATION (US) 1983-05-17 US claimed