SCHEMBL372327

SCHEMBL372327

C[n+]1ccn(C(F)(F)F)c1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
APAF1 O14727 1/20 0.31
NPC1 O15118 1/20 0.31
PLA2G1B P04054 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ATG4B Q9Y4P1 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
Fluoride Ion SCHEMBL1894673 0.98 MEN1 (0.31) MEN1APAF1NPC1PLA2G1BHSP90AA1
SCHEMBL422128 0.86
SCHEMBL428132 0.83 MEN1 (0.31) MEN1APAF1NPC1PLA2G1BHSP90AA1
SCHEMBL426069 0.81
SCHEMBL423942 0.78
SCHEMBL427412 0.78
SCHEMBL3765488 0.77 MEN1 (0.32) MEN1APAF1NPC1PLA2G1BHSP90AA1
SCHEMBL1219712 0.76
Bromide SCHEMBL2679419 0.76 MEN1 (0.31) MEN1APAF1NPC1PLA2G1BHSP90AA1
SCHEMBL1219637 0.74 LMNA (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9255195-B2 Ionic liquids, functionalized particulates, and fluoropolymer composites THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2016-02-09 US disclosed
EP-1981034-B1 ACTUATOR ELEMENT DAIKIN IND LTD (JP) 2016-01-13 EP disclosed
US-8722243-B2 Material for use as electrolyte, lithium secondary battery electrolyte, lithium secondary battery employing the same, and novel lithium salt THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2014-05-13 US disclosed
US-20140045977-A1 NOVEL IONIC LIQUIDS, FUNCTIONALIZED PARTICULATES, AND FLUOROPOLYMER COMPOSITES THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2014-02-13 US disclosed
US-8637601-B2 Fluorine-containing polymer having heteroaromatic ring DAIKIN INDUSTRIES, LTD. (JP) 2014-01-28 US disclosed
US-8563657-B2 Ionic liquids, functionalized particulates, and fluoropolymer composites THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2013-10-22 US disclosed
US-8545732-B2 Electrode film for polymer actuator element, and polymer actuator element comprising the same DAIKIN INDUSTRIES, LTD. (JP) 2013-10-01 US disclosed
EP-2587580-A1 ELECTROLYTE MATERIAL, ELECTROLYTE FOR LITHIUM SECONDARY BATTERY, LITHIUM SECONDARY BATTERY USING SAME, AND NOVEL LITHIUM SALT The Nippon Synthetic Chemical Industry Co., Ltd. (JP) 2013-05-01 EP disclosed
US-20130089777-A1 MATERIAL FOR USE AS ELECTROLYTE, LITHIUM SECONDARY BATTERY ELECTROLYTE, LITHIUM SECONDARY BATTERY EMPLOYING THE SAME, AND NOVEL LITHIUM SALT THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2013-04-11 US disclosed
EP-1698606-B1 FLUORINATING AGENT AND METHOD FOR PRODUCING FLUORINE-CONTAINING COMPOUND USING SAME SUMITOMO CHEMICAL CO (JP) 2013-02-20 EP disclosed
US-7939697-B2 Fluorinating agent and method for producing fluorine-containing compound using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-10 US disclosed
US-20110033647-A1 NOVEL IONIC LIQUIDS, FUNCTIONALIZED PARTICULATES, AND FLUOROPOLYMER COMPOSITES THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2011-02-10 US disclosed
US-20100164330-A1 ACTUATOR ELEMENT DAIKIN INDUSTRIES, LTD (JP) 2010-07-01 US disclosed
US-20090287025-A1 Fluorinating agent and method for producing fluorine-containing compound using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2009-11-19 US disclosed
US-7569703-B2 Fluorinating agent and method for producing fluorine-containing compound using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-08-04 US disclosed
US-20090105400-A1 Imidazolium side chains for example; for example polymers based on 1-methyl-3-(2H,9H,9H-perfluoro-3,6-dioxa-5-methyl-8-nonenyl)-imidazolium trifluoromethanesulfonate; polymer electrolytes for fuel cell, secondary battery, capacitor, dye-sensitized solar cell and electrochromic device DAIKIN INDUSTRIES, LTD. (JP) 2009-04-23 US disclosed
EP-1983008-A1 FLUORINE-CONTAINING POLYMER CONTAINING HETEROAROMATIC RING Daikin Industries, Ltd. (JP) 2008-10-22 EP disclosed
EP-1981034-A1 ACTUATOR ELEMENT Daikin Industries, Ltd. (JP) 2008-10-15 EP disclosed
US-20070135634-A1 Fluorinating agent and method for producing fluorine-containing compound using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2007-06-14 US disclosed
EP-1698606-A1 FLUORINATING AGENT AND METHOD FOR PRODUCING FLUORINE-CONTAINING COMPOUND USING SAME Sumitomo Chemical Company, Limited (JP) 2006-09-06 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110033647-A1 NOVEL IONIC LIQUIDS, FUNCTIONALIZED PARTICULATES, AND FLUOROPOLYMER COMPOSITES FLNA, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, F12 MEN1 2568/4885APAF1 3226/4885NPC1 3497/4885
US-20070135634-A1 Fluorinating agent and method for producing fluorine-containing compound using the same AFF1, AFF2, AFF4 MEN1 86/4885APAF1 1890/4885NPC1 449/4885
US-20090287025-A1 Fluorinating agent and method for producing fluorine-containing compound using the same AFF1, AFF2, AFF4 MEN1 86/4885APAF1 1890/4885NPC1 449/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.