SCHEMBL7749228

SCHEMBL7749228

CCCCCCCCCCCCCCCCC(C)SCCNC(=O)CCOc1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.48
CNR2 P34972 10/20 0.46
CNR1 P21554 9/20 0.46
HPGD P15428 1/20 0.44
LTA4H P09960 2/20 0.43
PLA2G4B P0C869 1/20 0.42
MAPT P10636 1/20 0.41

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
SCHEMBL7743713 0.95 CNR2 (0.53) NR5A1CNR2CNR1HPGD
SCHEMBL7747954 0.93 NR5A1 (0.45) NR5A1CNR2CNR1HPGDLTA4H
SCHEMBL7750813 0.92 NR5A1 (0.44) NR5A1CNR2CNR1LTA4HPLA2G4B
SCHEMBL7747879 0.89 TSHR (0.47) NR5A1HPGD
SCHEMBL7749322 0.88 NR5A1 (0.49) NR5A1LTA4HPLA2G4B
SCHEMBL7748382 0.88 NR5A1 (0.49) NR5A1LTA4HPLA2G4B
SCHEMBL7743827 0.88 NR5A1 (0.49) NR5A1LTA4HPLA2G4B
SCHEMBL7749313 0.87 NR5A1 (0.51) NR5A1LTA4HPLA2G4B
SCHEMBL7749142 0.85 NR5A1 (0.46) NR5A1LTA4HPLA2G4B
SCHEMBL7750897 0.85 NR5A1 (0.46) NR5A1LTA4HPLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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