SCHEMBL2582219

SCHEMBL2582219

OC(c1ccccc1C(O)(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
KDM4E B2RXH2 2/20 0.52
MAPT P10636 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MAPK1 P28482 2/20 0.52
LMNA P02545 1/20 0.52
HTT P42858 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
HSD17B10 Q99714 2/20 0.50
ALDH1A1 P00352 1/20 0.50
GLA P06280 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
HPGD P15428 1/20 0.50
ATM Q13315 1/20 0.50
NR1H2 P55055 6/20 0.43
NR1H3 Q13133 6/20 0.43
KCNJ11 Q14654 8/20 0.42
ABCC9 O60706 4/20 0.42

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
SCHEMBL23059981 0.88 ALDH1A1 (0.48) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL30353928 0.87 KDM4E (0.42) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL1873962 0.85 ALDH1A1 (0.50) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL24901411 0.85 MEN1 (0.46) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL5222166 0.83 SMN1; SMN2 (0.46) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL3380756 0.83 SMN1; SMN2 (0.55) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL19746100 0.83 MEN1 (0.44) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL14593291 0.81 KDM4E (0.66) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL14593292 0.81 KDM4E (0.57) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL11056698 0.81 MEN1 (0.42) MEN1KMT2AKDM4EMAPTSMN1; SMN2

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4477643-A Fluorinated polyurethanes THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1984-10-16 US claimed
EP-3201614-A1 DETECTING A MARKER IN A LIQUID Sicpa Holding SA (CH) 2017-08-09 EP disclosed
WO-2016050364-A1 DETECTING A MARKER IN A LIQUID SICPA HOLDING SA (CH) 2016-04-07 WO disclosed
WO-2011136872-A1 POLYMERS BEARING PENDANT PENTAFLUOROPHENYL ESTER GROUPS, AND METHODS OF SYNTHESIS AND FUNCTIONALIZATION THEREOF INTERNATIONAL BUSINESS MACHINES CORP. (US) 2011-11-03 WO disclosed
US-7553544-B2 Precursor composition for optical resin, resin for optical use, optical element, and optical article NIKON CORPORATION (JP) 2009-06-30 US disclosed
US-7553544-B2 Precursor composition for optical resin, resin for optical use, optical element, and optical article NIKON CORPORATION (JP) 2009-06-30 US disclosed
US-7169869-B2 Polymers, resist compositions and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-01-30 US disclosed
US-7169869-B2 Polymers, resist compositions and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-01-30 US disclosed
US-6733838-B2 CURING TOUGH FLUORINATED POLYURETHANE COATING THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2004-05-11 US disclosed
JP-2004059527-A BIS (1,1,1,3,3,3-HEXAFLUORO-2-HYDROXYPROPYL) BENZENE DERIVATIVE HAVING OXETANE RING TOAGOSEI CO LTD 2004-02-26 JP disclosed
JP-2004059527-A BIS (1,1,1,3,3,3-HEXAFLUORO-2-HYDROXYPROPYL) BENZENE DERIVATIVE HAVING OXETANE RING TOAGOSEI CO LTD 2004-02-26 JP disclosed
US-20030190482-A1 Robust nontoxic antifouling elastomers NAVY, UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE, THE 2003-10-09 US disclosed
US-20030113547-A1 Robust nontoxic antifouling elastomers NAVY, UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE, THE 2003-06-19 US disclosed
US-20020123608-A1 Fluorinated polymer and coating composition 21ST CENTURY COATINGS (AUST) PTY LTD (AU) 2002-09-05 US disclosed
WO-2000055238-A1 FLUORINATED POLYMER AND COATING COMPOSITION 21ST CENTURY COATINGS (AUST) PTY LTD (AU) 2000-09-21 WO disclosed
US-4990689-A 2,4-bis(2-hydroxyhexafluoro-2-propyl)fluorobenzene and method of preparing same CENTRAL GLASS COMPANY, LIMITED (JP) 1991-02-05 US disclosed
US-4482702-A Fl Polyesters THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1984-11-13 US disclosed
US-4132681-A Fluorinated polyether network polymers UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1979-01-02 US disclosed