SCHEMBL378733

SCHEMBL378733

N#Cc1cc(F)ccc1Oc1ccc2[nH]ncc2c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.46
TRPA1 O75762 3/20 0.45
LRRK2 Q5S007 2/20 0.42
EPAS1 Q99814 1/20 0.42
SLC22A12 Q96S37 12/20 0.41
ROCK1 Q13464 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C8 P10632 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KCNH2 Q12809 1/20 0.40
SLC22A6 Q4U2R8 1/20 0.40
SLC22A8 Q8TCC7 1/20 0.40
SLC22A11 Q9NSA0 1/20 0.40

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
SCHEMBL5409340 0.86 TRPA1 (0.58) ARTRPA1LRRK2ROCK1
SCHEMBL5043115 0.83 ROCK1 (0.52) ARTRPA1EPAS1ROCK1
SCHEMBL2446561 0.81 SLC22A12 (0.42) TRPA1SLC22A12
SCHEMBL16004752 0.78 ROCK1 (0.43) TRPA1EPAS1ROCK1KCNH2
SCHEMBL28747165 0.75 AR (0.51) AREPAS1SLC22A12
SCHEMBL28707122 0.74 NOS1 (0.46) TRPA1ROCK1
SCHEMBL2445697 0.73 AR (0.44) ARSLC22A12CYP3A4CYP2C8CYP2C9
SCHEMBL2876364 0.73 ROCK1 (0.58) TRPA1EPAS1ROCK1
SCHEMBL3497213 0.72 TRPA1 (0.59) TRPA1ROCK1
SCHEMBL5410044 0.72 TRPA1 (0.51) TRPA1LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2039685-B1 Heterobicyclic compounds as P38 inhibitors ARRAY BIOPHARMA INC (US) 2012-12-26 EP claimed
EP-1019437-B1 METHOD FOR THE COVALENT ATTACHMENT OF POLYSACCHARIDES TO PROTEIN MOLECULES CONNAUGHT LAB (US) 2012-01-25 EP claimed
EP-0584192-A1 PRODRUG ESTERS OF PHENOLIC 2-PIPERIDINO-1-ALKANOLS PFIZER INC. (US) 1994-03-02 EP claimed
CN-1065866-A The prodrug esters of phenol 2-piperidino-(1-position only)-1-alkanol PFIZER (US) 1992-11-04 CN claimed
WO-1992018502-A1 PRODRUG ESTERS OF PHENOLIC 2-PIPERIDINO-1-ALKANOLS PFIZER INC. (US) 1992-10-29 WO claimed
EP-0024182-B1 THERMO-STABLE MICRO-ORGANISM AND PROTEOLYTIC ENZYME PREPARED THEREFROM, AND PROCESSES FOR THE PREPARATION OF THE MICRO-ORGANISM AND THE PROTEOLYTIC ENZYME DEVELOPMENT FINANCE CORPORATION OF NEW ZEALAND (NZ) 1986-05-07 EP claimed
US-20240118273-A1 METHODS, SYSTEMS, AND ARRAYS FOR BIOMOLECULAR ANALYSIS VIBRANT HOLDINGS, LLC 2024-04-11 US disclosed
EP-3965887-B1 ANTIMICROBIAL CHITOSAN UNIV GENEVE (CH) 2024-02-28 EP disclosed
US-11815512-B2 Methods, systems, and arrays for biomolecular analysis VIBRANT HOLDINGS, LLC (US) 2023-11-14 US disclosed
US-20230294064-A1 SUBSTRATES, SYSTEMS, AND METHODS FOR NUCLEIC ACID ARRAY SYNTHESIS VIBRANT HOLDINGS, LLC 2023-09-21 US disclosed
US-11674956-B2 Methods, systems, and arrays for biomolecular analysis VIBRANT HOLDINGS, LLC (US) 2023-06-13 US disclosed
US-20220193244-A1 ANTIMICROBIAL TAILORED CHITOSAN UNIVERSITE DE GENEVE (CH) 2022-06-23 US disclosed
US-20210339247-A1 METHODS, TOOLS, AND TOOL ASSEMBLIES FOR BIOMOLECULAR ANALYSIS USING MICROARRAYS VIBRANT HOLDINGS, LLC 2021-11-04 US disclosed
US-4440926-A Heparin esters and processes for their preparation PHARMINDUSTRIE (FR) 1984-04-03 US disclosed
US-4419444-A AGGLUTINATION INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE-INSERM (FR) 1983-12-06 US disclosed
EP-0093652-A1 Synthetic toxin ST, process for its preparation and its use as a vaccination agent INSTITUT PASTEUR (FR) 1983-11-09 EP disclosed
US-4307228-A Protein adsorbent and process for the purification of urokinase NIPPON SODA COMPANY LIMITED (JP) 1981-12-22 US disclosed
US-4259448-A HYDROPHOBIC CHROMATOGRAPHY NIPPON SODA COMPANY, LTD. (JP) 1981-03-31 US disclosed
US-4225675-A A WATER INSOLUBLE CARRIER BOUND TO A PHENYL AMINE NIPPON SODA COMPANY, LTD. (JP) 1980-09-30 US disclosed
US-4217338-A MEDICAL DIAGNOSIS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE - INSERM (FR) 1980-08-12 US disclosed