Diphenylether

Diphenylether

SCHEMBL6570480

C=CCS(=O)(=O)O.c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
GAA P10253 2/20 0.45
RAB9A P51151 2/20 0.45
GLA P06280 1/20 0.45
LTA4H P09960 3/20 0.44
TSHR P16473 2/20 0.44
TGM2 P21980 1/20 0.44
SOS1 Q07889 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
ALDH1A1 P00352 3/20 0.41
MMP9 P14780 1/20 0.41
NR1H2 P55055 1/20 0.41
BAX Q07812 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 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
Biphenyl SCHEMBL10561027 0.82 ALDH1A1 (0.40) HTTSMN1; SMN2GAATSHRCA1
Benzene SCHEMBL6408353 0.82 ALDH1A1 (0.35) HTTSMN1; SMN2TSHRALDH1A1KDM4E
Phenol SCHEMBL1792651 0.81 ESR1 (0.45) HTTSMN1; SMN2GLATSHRCA1
Naphthalene SCHEMBL27669760 0.80 ALDH1A1 (0.45) HTTSMN1; SMN2TSHRALDH1A1KDM4E
Diphenylether SCHEMBL7044808 0.80 PABPC1 (0.47) HTTSMN1; SMN2GAARAB9AGLA
SCHEMBL27498267 0.79 ALDH1A1 (0.38) HTTSMN1; SMN2GAARAB9ATSHR
Styrene SCHEMBL11068282 0.79 ALDH1A1 (0.54) HTTSMN1; SMN2GAATSHRALDH1A1
Toluene SCHEMBL28021304 0.79 TSHR (0.42) HTTSMN1; SMN2RAB9ATSHRCA9
Styrene SCHEMBL4557949 0.79 ALDH1A1 (0.54) HTTSMN1; SMN2GAATSHRALDH1A1
Diphenylether SCHEMBL19733094 0.79 HTT (0.43) HTTSMN1; SMN2GAARAB9AGLA

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-6521028-B1 Quaternary ammonium salts, particularly pyridinium and quinolinium salts. By preparing these salts in a solvent selected from the group consisting of propylene glycols, propylene glycol ethers and mixtures thereof, the production HYDROCHEM INDUSTRIAL SERVICES, INC. 2003-02-18 US claimed
US-20040179075-A1 Ink-jet recording medium of plain paper type NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2004-09-16 US disclosed
EP-1405731-A1 INK-JET RECORDING MEDIUM OF PLAIN PAPER TYPE NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2004-04-07 EP disclosed
US-6521028-B1 Quaternary ammonium salts, particularly pyridinium and quinolinium salts. By preparing these salts in a solvent selected from the group consisting of propylene glycols, propylene glycol ethers and mixtures thereof, the production HYDROCHEM INDUSTRIAL SERVICES, INC. 2003-02-18 US disclosed
US-6118000-A REACTING PYRIDINE WITH DODECYL BROMIDE IN PRESENCE OF DIPROPYLENE GLYCOL HYDROCHEM INDUSTRIAL SERVICES, INC. (US) 2000-09-12 US disclosed
US-4637899-A PYRIDINIUM OR QUINOLINIUM SALT, SULFUR CONTAINING COMPOUND; INDUSTRAIL DOWELL SCHLUMBERGER INCORPORATED (US) 1987-01-20 US disclosed