SCHEMBL2432674

SCHEMBL2432674

FC(F)(F)c1cccc(B2OB(c3cccc(C(F)(F)F)c3)OB(c3cccc(C(F)(F)F)c3)O2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
MAPK1 P28482 1/20 0.47
CES2 O00748 1/20 0.42
MGLL Q99685 1/20 0.42
ALDH1A1 P00352 2/20 0.41
TAAR1 Q96RJ0 1/20 0.40
IDO1 P14902 2/20 0.39
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
HTR3A P46098 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 1/20 0.39
KIF11 P52732 1/20 0.39
NOTUM Q6P988 1/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
SCN2A Q99250 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37
USP2 O75604 1/20 0.37

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
SCHEMBL14227187 0.81 TSHR (0.41) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL10248 0.80 LPL (0.48) TSHRMAPK1CES2MGLLHTR2A
SCHEMBL7860024 0.79 TSHR (0.41) TSHR
SCHEMBL14227240 0.78 TSHR (0.39) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL6680366 0.78 CES2 (0.39) TSHRCES2ALDH1A1IDO1MAPT
SCHEMBL5892448 0.76 LMNA (0.45) TSHRMAPK1CES2MGLLHTR2A
SCHEMBL5892475 0.76 HTR1A (0.47) TSHRMAPK1ALDH1A1HTR3EHTR3B
SCHEMBL62723 0.74 TSHR (0.67) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL1484011 0.73 TSHR (0.35) TSHRMAPK1CES2MGLLALDH1A1
SCHEMBL31336168 0.73 ALDH1A1 (0.42) ALDH1A1HTR3EHTR3BHTR3AHTR3D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115065-A1 ION-CONDUCTIVE COMPOSITE ELECTROLYTE, MEMBRANE-ELECTRODE ASSEMBLY USING THE SAME, ELECTROCHEMICAL DEVICE USING MEMBRANE-ELECTRODE ASSEMBLY, AND METHOD FOR PRODUCING ION-CONDUCTIVE COMPOSITE ELECTROLYTE MEMBRANE SONY CORPORATION (JP) 2012-05-10 US disclosed
US-20110223518-A1 PROTON-CONDUCTIVE COMPOSITE ELECTROLYTE, MEMBRANE-ELECTRODE ASSEMBLY USING THE SAME, AND ELECTROCHEMICAL DEVICE USING MEMBRANE-ELECTRODE ASSEMBLY SONY CORPORATION (JP) 2011-09-15 US disclosed
EP-0736509-B1 Processes for preparing optically active alcohols and optically active amines SUMITOMO CHEMICAL CO (JP) 2001-11-14 EP disclosed
US-6025531-A REACTING A PROCHIRAL KETONE WITH A MIXTURE BORON-CONTAINING COMPOUNDS HAVING A BORANE REACTION PRODUCT FROM OPTICALLY ACTIVE BETA-AMINOALCOHOL AND A BORON HYDRIDE OR A METAL BOROHYDRIDE, AND AN OPTICALLY ACTIVE OXAZABOROLIDINE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-15 US disclosed
US-5801280-A Processes for preparing optically active alcohols and optically active amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-09-01 US disclosed
EP-0736509-A2 Processes for preparing optically active alcohols and optically active amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-10-09 EP disclosed