SCHEMBL7196965

SCHEMBL7196965

CCCCCCCCCCCCCCCCCCNC(=O)C(=O)NCCCOc1ccc(O)c(O)c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.55
TRPV1 Q8NER1 1/20 0.54
NAAA Q02083 1/20 0.52
CNR2 P34972 3/20 0.51
CNR1 P21554 2/20 0.51
APP P05067 1/20 0.49
ALOX12 P18054 1/20 0.49
NR5A1 Q13285 1/20 0.49

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
SCHEMBL7198036 0.92 TRPV1 (0.53) ADRB2TRPV1NAAACNR2CNR1
SCHEMBL7195031 0.91 ADRB2 (0.53) ADRB2TRPV1NAAACNR2CNR1
SCHEMBL7199892 0.87 NR5A1 (0.66) NR5A1
SCHEMBL7749083 0.86 ADRB2 (0.50) ADRB2TRPV1NAAACNR2CNR1
SCHEMBL7749223 0.86 NR5A1 (0.64) NR5A1
SCHEMBL7197076 0.85 NR5A1 (0.71) NR5A1
SCHEMBL7750826 0.84 ADRB2 (0.48) ADRB2TRPV1NAAACNR2CNR1
SCHEMBL7200841 0.84 LTA4H (0.66) NR5A1
SCHEMBL7199800 0.84 TRPV1 (0.52) ADRB2TRPV1NAAACNR2CNR1
SCHEMBL7196973 0.83 LTA4H (0.64) NR5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6596669-B1 Comprising a support and two reversible heat-sensitive recording layers having different colors formed on the same side of the support, comprising colorless electron-donative dye precursor and an electron-accepting compound MITSUBISHI PAPER MILLS LIMITED (JP) 2003-07-22 US disclosed
US-6184180-B1 COMPRISES SUPPORT, REVERSIBLE HEAT-SENSITIVE RECORDING LAYER CONTAINING DYE PRECURSOR WHICH IS COLORLESS OR A PALE COLOR, COLOR DEVELOPER CAPABLE OF CAUSING REVERSIBLE CHANGE IN COLOR DENSITY OF DYE DUE TO DIFFERENCE IN COOLING RATE MITSUBISHI PAPER MILLS LIMITED (JP) 2001-02-06 US disclosed