SCHEMBL5672906

SCHEMBL5672906

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

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.59
HPGD P15428 2/20 0.42
ALDH1A1 P00352 5/20 0.42
TP53 P04637 3/20 0.42
HIF1A Q16665 3/20 0.42
CYP3A4 P08684 3/20 0.42
HSD17B10 Q99714 1/20 0.42
MAPT P10636 4/20 0.41
SLC22A16 Q86VW1 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.38
MAPK1 P28482 1/20 0.38
THRB P10828 2/20 0.36
CHRM2 P08172 2/20 0.35
CHRM4 P08173 2/20 0.35
CHRM1 P11229 2/20 0.35
TBXA2R P21731 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 2/20 0.34
CHRM5 P08912 1/20 0.34
CHRM3 P20309 1/20 0.34

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
Iodide SCHEMBL1255401 0.98 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL434986 0.98 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
Fluoride Ion SCHEMBL1252819 0.98 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
Bromide SCHEMBL1254203 0.98 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL28204650 0.96 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL28204649 0.94 TSHR (0.53) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL9505637 0.91 TSHR (0.50) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL95157 0.85 TSHR (0.64) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL29254308 0.83 TSHR (0.47) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL11101174 0.83 TSHR (0.53) TSHRHPGDALDH1A1TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1511781-B1 CATIONIC CORE-SHELL PARTICLES WITH ACID-SWELLABLE SHELLS MEADWESTVACO CORP LAW DEPT (US) 2006-01-18 EP claimed
US-20050083386-A1 Cationic swellable dispersion polymers for ink jet coatings MEADWESTVACO CORPORATION 2005-04-21 US claimed
EP-1524279-A1 Cationic swellable dispersion polymers for ink jet coating Meadwestvaco Corporation (US) 2005-04-20 EP claimed
EP-1511781-A1 CATIONIC CORE-SHELL PARTICLES WITH ACID-SWELLABLE SHELLS MEADWESTVACO CORPORATION, Law Department (US) 2005-03-09 EP claimed
EP-1504044-A2 CORE-SHELL POLYMERIC COMPOSITIONS MEADWESTVACO CORPORATION, Law Department (US) 2005-02-09 EP claimed
US-6767638-B2 Core-shell polymeric compositions MEADWESTVACO CORPORATION 2004-07-27 US claimed
WO-2003106520-A1 CATIONIC CORE-SHELL PARTICLES WITH ACID-SWELLABLE SHELLS MEADWESTVACO CORPORATION (US) 2003-12-24 WO claimed
WO-2003097709-A2 CORE-SHELL POLYMERIC COMPOSITIONS MEADWESTVACO CORPORATION (US) 2003-11-27 WO claimed
US-20030215604-A1 Core-shell polymeric compositions WESTVACO CORPORATION (US) 2003-11-20 US claimed
US-6572969-B1 Core shell polymeric compositions MEADWESTVACO CORPORATION 2003-06-03 US claimed
US-6521342-B1 Cationic core-shell particles with acid-swellable shells WESTVACO CORPORATION 2003-02-18 US claimed
US-6521343-B1 Cationic core-shell particles with stabilizer-containing acid-swellable shells WESTVACO CORPORATION 2003-02-18 US claimed
EP-0187281-B1 NOVEL CARBOXYLATE POLYMERS AND PROCESSES FOR THEIR PREPARATION AND USE RHONE-POULENC SPECIALTY CHEMICALS CO. (US) 1993-06-23 EP claimed
US-4808668-A SEWAGE TREATMENT FLOCCULANT ALLIED-SIGNAL INC. (US) 1989-02-28 US claimed
EP-0187281-A2 Novel carboxylate polymers and processes for their preparation and use RHONE-POULENC SPECIALTY CHEMICALS CO. (US) 1986-07-16 EP claimed
CN-105814095-B Light moisture-curable resin combination, electronic component-use bonding agent and display element bonding agent 积水化学工业株式会社 2019-03-22 CN disclosed
CN-107109083-A The composition of radiation-hardenable comprising hydrophilic nano 罗利克有限公司 2017-08-29 CN disclosed
EP-0187281-A2 Novel carboxylate polymers and processes for their preparation and use RHONE-POULENC SPECIALTY CHEMICALS CO. (US) 1986-07-16 EP disclosed
US-4473813-A CROSSLINKED SILICONE RESIN HITACHI, LTD. (JP) 1984-09-25 US disclosed
EP-0076131-A1 Humidity sensor and method for preparing a humidity sensor Hitachi, Ltd. (JP) 1983-04-06 EP disclosed