Diphenylether

Diphenylether

SCHEMBL5067162

C=C.C=C.C=C.C=C.C=C.C=C.C=C.C=C.C=C.C=C.C=C.C=C.C=C.CCOCC.OCCO.OCCO.c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 7/20 0.53
TSHR P16473 2/20 0.48
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
CRHBP P24387 1/20 0.44
RAB9A P51151 1/20 0.44
CRHR2 Q13324 1/20 0.44
NR1H2 P55055 1/20 0.43
BAX Q07812 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RECQL P46063 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39

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
Diphenylether SCHEMBL22634177 0.87 LTA4H (0.63) LTA4HTSHRNR1H2BAXALDH1A1
Diphenylether SCHEMBL11414038 0.87 LTA4H (0.63) LTA4HTSHRNR1H2BAXALDH1A1
Diphenylether SCHEMBL12970954 0.87 LTA4H (0.63) LTA4HTSHRNR1H2BAXALDH1A1
Diphenylether SCHEMBL7456599 0.87 LTA4H (0.67) LTA4HTSHRNPC1HPGDCRHBP
Diphenylether SCHEMBL4623898 0.87 LTA4H (0.63) LTA4HTSHRNR1H2BAXALDH1A1
Diphenylether SCHEMBL4624646 0.87 LTA4H (0.63) LTA4HTSHRNR1H2BAXALDH1A1
Diphenylether SCHEMBL4623522 0.87 LTA4H (0.63) LTA4HTSHRNR1H2BAXALDH1A1
Diphenylether SCHEMBL11438863 0.86 LTA4H (0.52) LTA4HTSHRNPC1HPGDCRHBP
Diphenylether SCHEMBL3797141 0.85 LTA4H (0.47) LTA4HTSHRNPC1HPGDCRHBP
Biphenyl SCHEMBL11060969 0.83 ALDH1A1 (0.40) NPC1HPGDRAB9ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080099393-A1 PROCESS FOR RECYCLING PAINT FLUSH SOLUTION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-05-01 US disclosed