SCHEMBL7743820

SCHEMBL7743820

CCCCCCCCC(C)OCCNC(=O)NCCCCCCOc1ccc(O)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.53
LTA4H P09960 2/20 0.48
EPHX2 P34913 1/20 0.46
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
PPARG P37231 2/20 0.42
PPARA Q07869 1/20 0.42
PLA2G4B P0C869 1/20 0.42
EPHX1 P07099 3/20 0.42
KDM4E B2RXH2 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.42
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL7743717 0.95 NR5A1 (0.52) NR5A1LTA4HTP53TSHRABCG2
SCHEMBL7743736 0.95 NR5A1 (0.52) NR5A1LTA4HTP53TSHRABCG2
SCHEMBL7749113 0.90 NR5A1 (0.51) NR5A1LTA4HTP53TSHRABCG2
SCHEMBL7743731 0.89 NR5A1 (0.48) NR5A1LTA4HTP53TSHRPPARG
SCHEMBL7749291 0.89 NR5A1 (0.48) NR5A1LTA4HTP53TSHRPPARG
SCHEMBL7748401 0.88 NR5A1 (0.47) NR5A1LTA4HTP53TSHRABCG2
SCHEMBL7743062 0.88 CNR2 (0.55) NR5A1LTA4H
SCHEMBL7750954 0.87 NR5A1 (0.46) NR5A1LTA4HABCG2
SCHEMBL7743740 0.87 KDM4E (0.46) NR5A1LTA4HTSHRPLA2G4BKDM4E
SCHEMBL7199878 0.87 NR5A1 (0.71) NR5A1LTA4HTP53TSHRPLA2G4B

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