SCHEMBL718907

SCHEMBL718907

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A16 Q86VW1 1/20 0.45
MAPT P10636 3/20 0.40
TSHR P16473 3/20 0.39
CHRM2 P08172 2/20 0.39
CHRM4 P08173 2/20 0.39
CHRM1 P11229 2/20 0.39
TBXA2R P21731 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
CPT2 P23786 1/20 0.38
CPT1A P50416 1/20 0.38
GALR3 O60755 1/20 0.38
BLM P54132 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP1A2 P05177 1/20 0.37
HRH1 P35367 1/20 0.37
CRAT P43155 1/20 0.37
LMNA P02545 3/20 0.33
CHRM5 P08912 1/20 0.33
CHRM3 P20309 1/20 0.33

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
Water SCHEMBL16341077 0.98 SLC22A16 (0.43) SLC22A16MAPTTSHRCHRM2CHRM4
Iodide SCHEMBL10588910 0.98 SLC22A16 (0.43) SLC22A16MAPTTSHRCHRM2CHRM4
Hydrochloric Acid SCHEMBL719321 0.98 MAPT (0.43) SLC22A16MAPTTSHRCHRM2CHRM4
Hydrochloric Acid SCHEMBL9580738 0.98 SLC22A16 (0.43) SLC22A16MAPTTSHRCHRM2CHRM4
SCHEMBL5492929 0.87 MAPT (0.42) SLC22A16MAPTTSHRCHRM2CHRM4
Hydrochloric Acid SCHEMBL1471650 0.85 MAPT (0.45) SLC22A16MAPTTSHRCHRM2CHRM4
SCHEMBL366307 0.84 SLC22A16 (0.38) SLC22A16MAPTTSHRCHRM2CHRM4
SCHEMBL23421811 0.83 BBOX1 (0.35) SLC22A16
SCHEMBL367873 0.82 PGK1 (0.35) SLC22A16MAPTTSHRCHRM2CHRM4
SCHEMBL19900684 0.78 ACHE (0.35) SLC22A16CHRM2CHRM4CHRM1TBXA2R

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7754455-B2 Biocatalytic manufacturing of (meth) acrylylcholine or 2-(N, N-dimethylamino) ethyl (meth) acrylate CIBA SPECIALTY CHEMICALS WATER TREATMENTS LTD. (GB) 2010-07-13 US claimed
WO-2026098738-A1 METHOD AND APPARATUS FOR HOT PLATE WELDING OF THERMOPLASTICS JIHOCESKA UNIVERZITA V CESKYCH BUDEJOVICICH (CZ) 2026-05-15 WO disclosed
CN-119032149-A Polishing agent and polishing method 株式会社力森诺科 2024-11-26 CN disclosed
WO-2024143473-A1 DECOMPOSITION INHIBITOR FOR TRANSITION METAL OXIDANTS 株式会社トクヤマ 2024-07-04 WO disclosed
CN-110769800-B Cosmetic composition containing fullerene 维生素C60生化学研究公司 2022-06-28 CN disclosed
EP-3719113-A1 CELL CULTURE CONTAINER CAPABLE OF LONG-TERM CULTURE, AND METHOD FOR MANUFACTURING SAME Nissan Chemical Corporation (JP) 2020-10-07 EP disclosed
US-9150414-B2 Nanocomposite and dispersion comprising the same KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2015-10-06 US disclosed
US-20120053288-A1 NANOCOMPOSITE AND DISPERSION COMPRISING THE SAME KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2012-03-01 US disclosed
US-4237016-A NONIONIC SOFTENING AGENT AND A POLYMERIC CATIONIC SALT THE PROCTER & GAMBLE COMPANY (US) 1980-12-02 US disclosed
EP-0002085-A2 Textile conditioning compositions with low content of cationic guar gum THE PROCTER & GAMBLE COMPANY (US) 1979-05-30 EP disclosed