SCHEMBL1469079

SCHEMBL1469079

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.38
HTT P42858 2/20 0.38
XBP1 P17861 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
MAPK1 P28482 2/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
LMNA P02545 4/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
GAA P10253 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL1471610 0.87 NPSR1 (0.49) NPSR1HTTXBP1L3MBTL1MAPK1
SCHEMBL1011124 0.84 SLC6A2 (0.42) NPSR1HTTXBP1MAPK1HPGD
SCHEMBL1469479 0.81 SLC6A2 (0.41) NPSR1HTTXBP1MAPK1HPGD
SCHEMBL1469526 0.81 HTT (0.45) NPSR1HTTXBP1MAPK1SLC6A2
SCHEMBL1469080 0.81 NPSR1 (0.36) NPSR1HTTXBP1L3MBTL1MAPK1
SCHEMBL1276964 0.77 SLC6A2 (0.42) NPSR1HTTXBP1MAPK1HPGD
SCHEMBL15676649 0.75 ALDH1A1 (0.38) NPSR1HTTXBP1L3MBTL1MAPK1
SCHEMBL20594777 0.75 SLC6A2 (0.43) NPSR1HTTXBP1MAPK1SLC6A2
SCHEMBL1011125 0.74 CES2 (0.44) HTTMAPK1HPGDSLC6A2SLC6A4
SCHEMBL1469339 0.74 LMNA (0.33) NPSR1HTTXBP1MAPK1HPGD

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