SCHEMBL8624655

SCHEMBL8624655

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

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
FAAH O00519 14/20 0.55
POLB P06746 1/20 0.55
S1PR1 P21453 2/20 0.52
S1PR3 Q99500 2/20 0.52

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
SCHEMBL8624890 0.91 FAAH (0.56) GAAL3MBTL1FAAHS1PR1S1PR3
SCHEMBL8622057 0.90 GAA (0.60) GAAL3MBTL1FAAHPOLB
SCHEMBL8621093 0.87 NR5A1 (0.69) GAAL3MBTL1FAAHPOLB
SCHEMBL4423437 0.82 GAA (0.70) GAAL3MBTL1FAAHS1PR1S1PR3
SCHEMBL8622044 0.82 POLB (0.59) POLB
SCHEMBL25885457 0.81 GAA (0.77) GAAL3MBTL1FAAHS1PR1S1PR3
SCHEMBL8627168 0.81 FAAH (0.56) GAAL3MBTL1FAAH
SCHEMBL8626992 0.80 TRPV1 (0.63) POLB
SCHEMBL8628167 0.80 TRPV1 (0.63) POLB
SCHEMBL8626443 0.80 TRPV1 (0.63) POLB

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