SCHEMBL543169

SCHEMBL543169

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

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.43
HPGD P15428 1/20 0.33
ALDH1A1 P00352 4/20 0.32
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
CYP3A4 P08684 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 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
Bromide SCHEMBL1302365 0.98 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
Fluoride Ion SCHEMBL1302520 0.98 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
Water SCHEMBL27986549 0.98 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
Iodide SCHEMBL1301992 0.98 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL153549 0.98 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
Chloromethane SCHEMBL27537377 0.96 TSHR (0.41) TSHRHPGDALDH1A1TP53HIF1A
Acrylic Acid SCHEMBL29117105 0.92 LMNA (0.39) TSHRHCAR2
Hydrochloric Acid SCHEMBL27884464 0.92 TSHR (0.38) TSHR
Sulfuric Acid SCHEMBL29003465 0.92 TSHR (0.38) TSHR
Sulfuric Acid SCHEMBL19066915 0.90 TSHR (0.37) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119505120-A Polyion elastomer material and preparation method and application thereof 电子科技大学 2025-02-25 CN claimed
CN-119371592-A Preparation method and application of lithium inner salt zwitterionic polymer electrolyte 中国科学院广州能源研究所 2025-01-28 CN claimed
US-20240426013-A1 SYSTEM AND METHOD OF SELECTIVE ELECTRODEPOSITION FOR METAL RECYCLING THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-12-26 US claimed
CN-118684837-B Reverse demulsifier for fracturing flowback fluid and preparation method thereof 四川兴澳环境技术服务有限公司 2024-11-01 CN claimed
CN-118684837-A Reverse demulsifier for fracturing flowback fluid and preparation method thereof 四川兴澳环境技术服务有限公司 2024-09-24 CN claimed
EP-3854933-B1 MANUFACTURE OF ELECTRO-MAGNETIC SHIELDING TEXTILES WITH CONDUCTIVE ORGANIC POLYMERIC COATING SRI CENTER FOR PHYSICAL SCIENCES AND TECH (LT) 2024-08-07 EP claimed
WO-2023239394-A9 SYSTEM AND METHOD OF SELECTIVE ELECTRODEPOSITION FOR METAL RECYCLING THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-08-02 WO claimed
CN-114514251-B Polymer dispersions and fabric conditioning compositions comprising the same 罗地亚经营管理公司 2024-06-14 CN claimed
WO-2023239394-A2 SYSTEM AND METHOD OF SELECTIVE ELECTRODEPOSITION FOR METAL RECYCLING THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2023-12-14 WO claimed
CN-117209663-A High molecular weight polymer dispersions produced under controlled adiabatic conditions 索理思科技开曼公司 2023-12-12 CN claimed
WO-1999034058-A1 OXIDIZED GALACTOSE TYPE OF ALCOHOL CONFIGURATION CONTAINING POLYMER IN COMBINATION WITH CATIONIC POLYMERS FOR PAPER STRENGTH APPLICATIONS HERCULES INCORPORATED (US) 1999-07-08 WO claimed
EP-0900299-A1 COMPOSITIONS AND METHODS FOR INHIBITING DEPOSITS IN PULP AND PAPERMAKING SYSTEMS BetzDearborn Inc (US) 1999-03-10 EP claimed
EP-0900299-A4 1999-03-10 EP claimed
US-5708071-A FLOCCULATION, SEWAGE TREATMENT HYMO CORPORATION (JP) 1998-01-13 US claimed
EP-0521666-B1 Ampholyte terpolymers providing superior conditioning properties in shampoos and other hair care products CALGON CORP (US) 1997-12-10 EP claimed
WO-1997044519-A1 COMPOSITIONS AND METHODS FOR INHIBITING DEPOSITS IN PULP AND PAPERMAKING SYSTEMS BETZDEARBORN INC. (US) 1997-11-27 WO claimed
EP-0717056-A2 An aqueous dispersion of an amphoteric water-soluble polymer, a method of manufacturing the same, and a treating agent comprising the same HYMO CORPORATION (JP) 1996-06-19 EP claimed
EP-0469196-B1 Terpolymer flocculants S N F (FR) 1995-10-11 EP claimed
EP-0161773-B1 SURFACTANT SYSTEM FOR EMULSION POLYMERS CALGON CORPORATION (US) 1988-11-09 EP claimed
US-4525509-A REDUCE PARTICLE SIZE, ADD AMPHIPATHIC COMPOUND CALGON CORPORATION (US) 1985-06-25 US claimed