SCHEMBL7748382

SCHEMBL7748382

CCCCCCCCCCCCCCCCC(C)SCCNC(=O)C(=O)NCCCOc1ccc(O)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.49
LTA4H P09960 2/20 0.44
PLA2G4B P0C869 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ESR1 P03372 7/20 0.40
SLC2A1 P11166 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL7749322 0.91 NR5A1 (0.49) NR5A1LTA4HPLA2G4BESR1SLC2A1
SCHEMBL7743827 0.91 NR5A1 (0.49) NR5A1LTA4HPLA2G4BESR1SLC2A1
SCHEMBL7750826 0.91 ADRB2 (0.48) NR5A1
SCHEMBL7749313 0.90 NR5A1 (0.51) NR5A1LTA4HPLA2G4BTP53TSHR
SCHEMBL7749142 0.89 NR5A1 (0.46) NR5A1LTA4HPLA2G4BESR1SLC2A1
SCHEMBL7750897 0.89 NR5A1 (0.46) NR5A1LTA4HPLA2G4BESR1SLC2A1
SCHEMBL7749228 0.88 NR5A1 (0.48) NR5A1LTA4HPLA2G4B
SCHEMBL7743713 0.87 CNR2 (0.53) NR5A1
SCHEMBL7747879 0.86 TSHR (0.47) NR5A1HTTSMN1; SMN2TSHR
SCHEMBL7747954 0.85 NR5A1 (0.45) NR5A1LTA4HPLA2G4BSLC2A1

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