SCHEMBL8624890

SCHEMBL8624890

CCCCCCCCCCCCCCCCCCOc1ccc(NC(=O)C(=O)Nc2ccc(O)c(O)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 14/20 0.56
GAA P10253 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
S1PR1 P21453 1/20 0.53
S1PR3 Q99500 1/20 0.53
NAMPT P43490 1/20 0.52
NR5A1 Q13285 1/20 0.51

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
SCHEMBL8624655 0.91 GAA (0.60) FAAHGAAL3MBTL1S1PR1S1PR3
SCHEMBL8627168 0.90 FAAH (0.56) FAAHGAAL3MBTL1
SCHEMBL8626267 0.86 NR5A1 (0.71) FAAHGAAL3MBTL1S1PR1S1PR3
SCHEMBL14462685 0.83 FAAH (0.73) FAAHGAAL3MBTL1NAMPT
SCHEMBL14462655 0.83 FAAH (0.61) FAAHGAAL3MBTL1S1PR1S1PR3
SCHEMBL12919806 0.82 FAAH (0.60) FAAHNAMPT
SCHEMBL8626430 0.81 THRA (0.57) S1PR1
SCHEMBL8622057 0.81 GAA (0.60) FAAHGAAL3MBTL1
SCHEMBL5382350 0.80 FAAH (0.72) FAAHGAAL3MBTL1NAMPT
SCHEMBL14462654 0.80 RARB (0.58) FAAHGAAL3MBTL1S1PR1S1PR3

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
EP-0648612-B1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS LTD (JP) 1998-06-10 EP disclosed
US-5498772-A SUBSTRATE WITH HEAT SENSITIVE LAYER AND OPTICAL RECORDING LAYER MITSUBISHI PAPER MILLS LIMITED (JP) 1996-03-12 US disclosed
EP-0648612-A1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1995-04-19 EP disclosed