SCHEMBL7200527

SCHEMBL7200527

CCCCCCCCCCCCCCCCCCSCC(=O)NCOc1ccc(Oc2ccc(O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.51
NR5A1 Q13285 1/20 0.47
PLA2G4B P0C869 7/20 0.46
ALDH1A1 P00352 1/20 0.40
CES2 O00748 1/20 0.39
GMNN O75496 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
CYP2C9 P11712 1/20 0.39
BLM P54132 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39

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
SCHEMBL7200908 0.89 PLA2G4B (0.51) LTA4HNR5A1PLA2G4BESR1ESR2
SCHEMBL7200500 0.84 LTA4H (0.57) LTA4HNR5A1
SCHEMBL7201645 0.84 LTA4H (0.57) LTA4HNR5A1
SCHEMBL7750923 0.79 NR5A1 (0.57) LTA4HNR5A1
SCHEMBL7198051 0.79 NR5A1 (0.57) LTA4HNR5A1
SCHEMBL7748289 0.75 PSMB11 (0.55) LTA4HPLA2G4BALDH1A1TP53MAPT
SCHEMBL7743598 0.74 PLA2G4B (0.55) LTA4HNR5A1PLA2G4B
SCHEMBL7199958 0.74 TSHR (0.59) LTA4HNR5A1ALDH1A1CYP2C9
SCHEMBL7194099 0.74 TSHR (0.59) LTA4HNR5A1ALDH1A1CYP2C9
SCHEMBL23220486 0.73 NR5A1 (0.80) LTA4HNR5A1PLA2G4BTP53MAPT

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-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