SCHEMBL1685381

SCHEMBL1685381

FC(F)(F)c1ccccc1Oc1ccccc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.46
PTGS2 P35354 1/20 0.46
MRGPRX1 Q96LB2 1/20 0.45
IDO1 P14902 2/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
PPARG P37231 1/20 0.43
HTR1A P08908 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP3A4 P08684 1/20 0.40
ESRRA P11474 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
ADRA2A P08913 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
SCHEMBL11048002 0.97 LTA4H (0.45) LTA4HPTGS2MRGPRX1IDO1RXRA
SCHEMBL11521654 0.88 LTA4H (0.58) LTA4HPTGS2MRGPRX1RXRARXRB
SCHEMBL10368048 0.87 RXRA (0.41) LTA4HPTGS2MRGPRX1IDO1RXRA
SCHEMBL11144791 0.87 LTA4H (0.40) LTA4HPTGS2MRGPRX1IDO1RXRA
SCHEMBL21858138 0.87 L3MBTL1 (0.47) LTA4HPTGS2MRGPRX1IDO1RXRA
SCHEMBL10902334 0.87 AR (0.53) LTA4HPTGS2MRGPRX1RXRARXRB
SCHEMBL1339067 0.87 KDM4E (0.52) LTA4HPTGS2MRGPRX1IDO1RXRA
SCHEMBL5379995 0.87 AR (0.53) LTA4HPTGS2MRGPRX1RXRARXRB
SCHEMBL1676646 0.86 LTA4H (0.53) LTA4HPTGS2MRGPRX1RXRARXRB
SCHEMBL946862 0.85 AR (0.41) LTA4HPTGS2MRGPRX1IDO1RXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115084655-A Electrolyte, preparation method thereof and lithium metal battery containing electrolyte 蜂巢能源科技(无锡)有限公司 2022-09-20 CN claimed
CN-113045934-A Printing ink, application thereof and preparation method of quantum dot film TCL集团股份有限公司 2021-06-29 CN claimed
CN-104927072-A Solvent-resistant polyimide thin film with low thermal expansion coefficient and preparation method for polyimide thin film LU AN CITY DUERBANG INSULATION MATERIALS CO LTD 2015-09-23 CN claimed
EP-1444508-A4 ION SELECTIVE ELECTRODES FOR DIRECT ORGANIC DRUG ANALYSIS IN SALIVA, SWEAT, AND SURFACE WIPES US GOV SEC NAVY (US) 2008-06-25 EP claimed
US-6780307-B2 PORTABLE DRUG MONITORING; QUANTITATIVE ANALYSIS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2004-08-24 US claimed
EP-1444508-A1 ION SELECTIVE ELECTRODES FOR DIRECT ORGANIC DRUG ANALYSIS IN SALIVA, SWEAT, AND SURFACE WIPES The Government of the United States of America as represented by the Secretary of the Navy (US) 2004-08-11 EP claimed
US-20030121779-A1 Portable drug monitoring; quantitative analysis NAVY, THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE 2003-07-03 US claimed
WO-2003034056-A1 ION SELECTIVE ELECTRODES FOR DIRECT ORGANIC DRUG ANALYSIS IN SALIVA, SWEAT, AND SURFACE WIPES THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2003-04-24 WO claimed
CN-115703698-B Preparation method of trifluoro vinyl alkyl ether compound and intermediate thereof 中国科学院上海有机化学研究所 2025-01-24 CN disclosed
US-20240027907-A1 METHOD FOR PRODUCING PATTERNED SUBSTRATE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2024-01-25 US disclosed
CN-115863765-A Electrolyte and battery comprising same 蜂巢能源科技股份有限公司 2023-03-28 CN disclosed
CN-115703698-A Preparation method of trifluorovinyl alkyl ether compound and intermediate thereof 中国科学院上海有机化学研究所 2023-02-17 CN disclosed
CN-115084655-A Electrolyte, preparation method thereof and lithium metal battery containing electrolyte 蜂巢能源科技(无锡)有限公司 2022-09-20 CN disclosed
CN-113045934-A Printing ink, application thereof and preparation method of quantum dot film TCL集团股份有限公司 2021-06-29 CN disclosed
US-20020115224-A1 Method for the preparation of optical (bio)chemical sensor devices VIR A/S (DK) 2002-08-22 US disclosed
US-6379955-B1 Optical fiberless sensors REGENTS OF THE UNIVERSITY OF MICHIGAN 2002-04-30 US disclosed
US-6239289-B1 PERFLUOROALKYLATING A NUCLEOPHILE; STABILITY DAIKIN INDUSTRIES LTD. (JP) 2001-05-29 US disclosed
US-6143558-A CELLS CONTAINING AT LEAST ONE FIBERLESS OPTICAL SENSOR OF A SOLID PARTICLE FROM 1 MICROMETER TO 1 NANOMETER IN DIAMETER AND HAVING ONE OR MORE ACTIVE SENSOR MOLECULES IMBEDDED IN PARTICLE; NONTOXIC MONITORING AT SEVERAL LOCATIONS IN A CELL THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2000-11-07 US disclosed
EP-1013651-A1 O-(PERFLUOROALKYL)DIBENZOFURANIUM SALT DERIVATIVES, INTERMEDIATES FOR THE PREPARATION OF THE SAME, PROCESS FOR THE PREPARATION OF THE INTERMEDIATES, PERFLUOROALKYLATING AGENTS, AND PROCESS FOR PERFLUOROALKYLATION Daikin Industries, Limited (JP) 2000-06-28 EP disclosed
WO-1999002651-A1 OPTICAL FIBERLESS SENSORS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1999-01-21 WO disclosed