SCHEMBL148163

SCHEMBL148163

FC(F)(F)c1cc[c]c(Br)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
MAPK1 P28482 1/20 0.35
ALDH1A1 P00352 2/20 0.33
PTPN5 P54829 1/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
CES2 O00748 3/20 0.32
PDE2A O00408 3/20 0.32
MGLL Q99685 1/20 0.32
TAS2R14 Q9NYV8 1/20 0.32
MAOB P27338 1/20 0.32
KIF11 P52732 1/20 0.32
CA2 P00918 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
GAA P10253 2/20 0.30
MAPT P10636 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
XBP1 P17861 1/20 0.30

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
SCHEMBL21061043 0.98 TSHR (0.34) TSHRMAPK1ALDH1A1PTPN5NOS3
SCHEMBL16439901 0.83
SCHEMBL1636885 0.77 ALDH1A1 (0.37) TSHRALDH1A1KIF11GAAMAPT
SCHEMBL146433 0.74 PDE2A (0.37) TSHRMAPK1ALDH1A1PTPN5NOS3
SCHEMBL149760 0.74 TSHR (0.37) TSHRMAPK1ALDH1A1PTPN5NOS3
SCHEMBL1079312 0.74 PDE2A (0.34) TSHRMAPK1ALDH1A1PTPN5NOS3
SCHEMBL28474116 0.74 ALOX15 (0.34) TSHRALDH1A1
SCHEMBL4852287 0.73 TSHR (0.45) TSHRMAPK1ALDH1A1PTPN5NOS3
SCHEMBL3081819 0.73 MGLL (0.41) TSHRMAPK1PTPN5NOS3NOS2
SCHEMBL9725680 0.73 TSHR (0.35) TSHRMAPK1ALDH1A1PTPN5NOS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3206683-A1 NOVEL METHODS, COMPOUNDS, AND COMPOSITIONS FOR ANESTHESIA The Board of Trustees of the Leland Stanford Junior University (US) 2017-08-23 EP claimed
WO-2016061538-A1 NOVEL METHODS, COMPOUNDS, AND COMPOSITIONS FOR ANESTHESIA THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2016-04-21 WO claimed
EP-2532663-B1 Naphthalenetetracarboxylic acid derivatives and their use as semiconductors BASF SE (DE) 2016-03-16 EP claimed
EP-2532663-A1 Naphthalenecarboxylic acid derivatives and their use as semiconductors BASF SE (DE) 2012-12-12 EP claimed
US-8217055-B2 Pyrido-pyrazine derivatives useful as herbicidal compounds SYNGENTA CROP PROTECTION LLC (US) 2012-07-10 US claimed
EP-1648886-B1 BENZOXAZINONE-DERIVED SULFONAMIDE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS ESTEVE LABOR DR (ES) 2009-12-09 EP claimed
EP-1937672-B1 N-[(4,5-DIPHENYLPYRIMIDIN-2-YL)METHYL]AMINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR THERAPEUTIC USE SANOFI AVENTIS (FR) 2009-09-02 EP claimed
US-7541361-B2 N-[4,5-diphenylpyrimidin-2-yl)methyl]amine derivatives, the preparation thereof and their therapeutic use SANOFI-AVENTIS (FR) 2009-06-02 US claimed
CN-101400653-A 11-beta HSD1 inhibitors WYETH CORP (US) 2009-04-01 CN claimed
EP-1981848-A2 11-BETA HSD1 INHIBITORS Wyeth (US) 2008-10-22 EP claimed
US-5914335-A INSECTICIDES RHONE-POULENC INC. (US) 1999-06-22 US claimed
WO-1998028279-A1 PESTICIDAL 1-ARYL AND PYRIDYLPYRAZOLE DERIVATIVES RHONE-POULENC AGROCHIMIE (FR) 1998-07-02 WO claimed
US-5714191-A PESTICIDES USED IN MEDICATED FEEDSTUFF, MINERAL SALT LICK OR EDIBLE BAIT RHONE-POULENC AGRICULTURE LTD. (GB) 1998-02-03 US claimed
US-5691333-A APPLYING TO CONTROL ARTHROPODS AND NEMATODES RHONE-POULENC INC. (US) 1997-11-25 US claimed
US-5629335-A Pesticidal 1-arylpyrazole-3-carboximidothioic acid esters RHONE-POULENC INC. (US) 1997-05-13 US claimed
US-5556873-A AGRICULTURAL PESTICIDES RHONE-POULENC INC. (US) 1996-09-17 US claimed
US-5236938-A Pesticidal 1-aryl-5-(substituted alkylideneimino)pyrazoles RHONE-POULENC INC. (US) 1993-08-17 US claimed
US-5232940-A Controlling insects, plant nematodes, helminths, protozoa BASF AGRO B.V., ARNHEM (NL), WADENSWIL-BRANCH (CH) 1993-08-03 US claimed
US-5177100-A Pesticides RHONE-POULENC AGRICULTURE LTD. (GB) 1993-01-05 US claimed
EP-0295117-A1 Derivatives of N-phenylpyrazoles RHONE-POULENC AGRICULTURE LIMITED (GB) 1988-12-14 EP claimed