SCHEMBL10180647

SCHEMBL10180647

O=C(Oc1c(F)cccc1F)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.57
SLC2A4 P14672 1/20 0.57
LMNA P02545 3/20 0.50
F2 P00734 1/20 0.50
KMT2A Q03164 8/20 0.48
MAPT P10636 5/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 2/20 0.47
MEN1 O00255 4/20 0.46
GAA P10253 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
JAK2 O60674 1/20 0.46
USP2 O75604 1/20 0.46
ESR1 P03372 1/20 0.46
ALOX15 P16050 1/20 0.46
ESR2 Q92731 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 3/20 0.46
PARP10 Q53GL7 1/20 0.46
ALDH1A1 P00352 3/20 0.43

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
SCHEMBL2886267 0.89 SLC2A1 (0.72) SLC2A1SLC2A4LMNAF2KMT2A
SCHEMBL10180049 0.85 LMNA (0.47) SLC2A1SLC2A4LMNAF2KMT2A
SCHEMBL10181363 0.85 MAPT (0.47) SLC2A1SLC2A4LMNAF2KMT2A
SCHEMBL27963877 0.83 LMNA (0.45) SLC2A1SLC2A4LMNAF2KMT2A
SCHEMBL5551848 0.83 LMNA (0.64) LMNAF2KMT2AMAPTSMN1; SMN2
SCHEMBL7086238 0.82 TSHR (0.54) LMNAF2KMT2AMAPTSMN1; SMN2
SCHEMBL29371761 0.81 KMT2A (0.45) SLC2A1SLC2A4LMNAF2KMT2A
SCHEMBL31591144 0.81 TSHR (0.48) SLC2A1SLC2A4LMNAF2KMT2A
SCHEMBL1323923 0.80 KMT2A (0.63) SLC2A1SLC2A4LMNAF2KMT2A
SCHEMBL10180669 0.79 KMT2A (0.58) SLC2A1SLC2A4LMNAF2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015008234-A1 BICYCLIC HETEROCYCLIC COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2015-01-22 WO disclosed
CN-104112870-A Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same MITSUBISHI CHEM CORP 2014-10-22 CN disclosed
US-20130244122-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME ONUKI MASAMICHI (JP) 2013-09-19 US disclosed
US-20120219866-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-30 US disclosed
EP-2475041-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE BATTERY COMPRISING SAME Mitsubishi Chemical Corporation (JP) 2012-07-11 EP disclosed