SCHEMBL4288726

SCHEMBL4288726

COC[C@]1(O)CCCC[C@H]1n1cnc(C(=O)N2CCN(C(=O)O)C[C@H]2CCOc2ccc[n+]([O-])c2)c1-c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 3/20 0.34
HCRTR2 O43614 3/20 0.34
FAAH O00519 1/20 0.31
CES2 O00748 1/20 0.31

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
SCHEMBL13705160 0.93 PARP1 (0.32) HCRTR1HCRTR2
SCHEMBL4285677 0.92 HCRTR1 (0.39) HCRTR1HCRTR2
SCHEMBL13705407 0.89 USP19 (0.35) HCRTR1HCRTR2
Hydrochloric Acid SCHEMBL4291377 0.88 USP19 (0.35) HCRTR1HCRTR2
SCHEMBL4296767 0.87 HCRTR1 (0.34) HCRTR1HCRTR2
SCHEMBL4281981 0.87 HCRTR1 (0.38) HCRTR1HCRTR2
SCHEMBL4282753 0.87 HCRTR1 (0.38) HCRTR1HCRTR2
SCHEMBL4287181 0.86 HCRTR1 (0.37) HCRTR1HCRTR2
SCHEMBL4282962 0.86 HCRTR1 (0.34) HCRTR1HCRTR2
SCHEMBL4284990 0.86 HCRTR1 (0.32) HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0389354-B1 Polyurethane layer having energy absorbing properties and its use in laminated safety glass SAINT GOBAIN VITRAGE (FR) 1995-07-26 EP claimed
WO-2023213069-A1 PREPARATION PROCESS FOR MODIFIED POLYAMIDE WAX FOR COATINGS, AND COATING FORMED THEREBY 浙江丰虹新材料股份有限公司 2023-11-09 WO disclosed
EP-4197044-A1 FLOW FIELD PLATE, FUEL CELL, AND PROCESS FOR MANUFACTURING A FLOW FIELD PLATE EKPO Fuel Cell Technologies GmbH (DE) 2023-06-21 EP disclosed
CN-113416371-B Resin composition, heat storage material, and article 昭和电工材料株式会社 2023-01-17 CN disclosed
EP-3692084-A1 TOUGHENED CYANOACRYLATE COMPOSITIONS Henkel IP & Holding GmbH (DE) 2020-08-12 EP disclosed
EP-3681923-A1 METHOD FOR THE PRODUCTION OF THERMOPLASTIC POLYOXAZOLIDINONE POLYMERS Covestro Deutschland AG (DE) 2020-07-22 EP disclosed
WO-2019068690-A1 TOUGHENED CYANOACRYLATE COMPOSITIONS Henkel IP & Holding GmbH (DE) 2019-04-11 WO disclosed
WO-2019052991-A1 METHOD FOR THE PRODUCTION OF THERMOPLASTIC POLYOXAZOLIDINONE POLYMERS COVESTRO DEUTSCHLAND AG (DE) 2019-03-21 WO disclosed
EP-3197678-A1 COLORLESS, TRANSPARENT AND HEAT RESISTANT POLYURETHANE FILMS AND METHODS FOR MANUFACTURING THE SAME Covestro Deutschland AG (DE) 2017-08-02 EP disclosed
WO-2016046293-A1 COLORLESS, TRANSPARENT AND HEAT RESISTANT POLYURETHANE FILMS AND METHODS FOR MANUFACTURING THE SAME COVESTRO DEUTSCHLAND AG (DE) 2016-03-31 WO disclosed
US-4767812-A POLYURETHANE OF HYDROXY-TERMINATED POLYBUTADIENE OR POLYISOPRENE AND DIPHENYLMETHANE DIISOCYANATE; 2,2-DICHLOROVINYL DIMETHYL PHOSPHATE AMERICAN TELEPHONE AND TELEGRAPH COMPANY, AT&T LABORATORIES (US) 1988-08-30 US disclosed
EP-0221950-A1 ELASTOMERIC CONTROLLED RELEASE FORMULATION AND ARTICLE COMPRISING SAME. AMERICAN TELEPHONE & TELEGRAPH (US) 1987-05-20 EP disclosed
WO-1986006252-A1 ELASTOMERIC CONTROLLED RELEASE FORMULATION AND ARTICLE COMPRISING SAME AMERICAN TELEPHONE & TELEGRAPH COMPANY (US) 1986-11-06 WO disclosed
EP-0185058-A1 AMERICAN TELEPHONE & TELEGRAPH 1986-06-25 EP disclosed
US-4594380-A Active material in polyurethane matrix AT&T BELL LABORATORIES (US) 1986-06-10 US disclosed
WO-1986000166-A1 ENCAPSULATING COMPOUND AND ARTICLES COMPRISING SAME AMERICAN TELEPHONE & TELEGRAPH COMPANY (US) 1986-01-03 WO disclosed
US-RE30321-E Mineral oil extended polyurethane system containing a coupling agent for decontaminating and sealing the interior spaces of an insulated electrical device N L INDUSTRIES, INC. (US) 1980-07-01 US disclosed
US-4176239-A POLYURETHANE N L INDUSTRIES, INC. (US) 1979-11-27 US disclosed
US-4171998-A Method for decontaminating and sealing the interior spaces of an insulated electrical device utilizing mineral oil-extended polyurethanes N L INDUSTRIES, INC. (US) 1979-10-23 US disclosed
US-4008197-A Mineral oil extended polyurethane system containing a coupling agent for decontaminating and sealing the interior spaces of an insulated electrical device N L INDUSTRIES, INC. (US) 1977-02-15 US disclosed