SCHEMBL1469080

SCHEMBL1469080

CCOP(=O)(OF)Oc1cccc(F)c1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.36
HTT P42858 2/20 0.36
XBP1 P17861 1/20 0.36
TSHR P16473 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
MAPK1 P28482 2/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
LMNA P02545 4/20 0.33
ALDH1A1 P00352 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MAPT P10636 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL1471612 0.88 HTT (0.47) NPSR1HTTXBP1TSHRL3MBTL1
SCHEMBL1276962 0.85 SLC6A2 (0.40) NPSR1HTTXBP1MAPK1BCHE
SCHEMBL1276965 0.85 SLC6A2 (0.40) NPSR1HTTXBP1MAPK1BCHE
SCHEMBL1469482 0.83 SLC6A2 (0.36) NPSR1HTTXBP1MAPK1BCHE
SCHEMBL1469079 0.81 NPSR1 (0.38) NPSR1HTTXBP1TSHRL3MBTL1
SCHEMBL20594777 0.80 SLC6A2 (0.43) NPSR1HTTXBP1MAPK1BCHE
SCHEMBL17355857 0.78 GAA (0.43) NPSR1HTTTSHRMAPK1CA1
SCHEMBL17356505 0.78 KCNK3 (0.41) NPSR1HTTTSHRMAPK1CA1
SCHEMBL1469528 0.75 SLC6A2 (0.36) HTTMAPK1LMNASLC6A2SLC6A4
SCHEMBL6685987 0.74 SLC6A2 (0.39) NPSR1HTTXBP1MAPK1BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120171542-A1 SECONDARY BATTERY NEC CORPORATION (JP) 2012-07-05 US disclosed
US-20110159379-A1 SECONDARY BATTERY NEC CORPORATION (JP) 2011-06-30 US disclosed
US-20110070504-A1 SECONDARY BATTERY NEC CORPORATION (JP) 2011-03-24 US disclosed