SCHEMBL20060982

SCHEMBL20060982

CCCOc1ccc(-c2cc(-c3ccc(C)cc3)cc(-c3ccc(O)cc3)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.62
NR5A1 Q13285 1/20 0.53
MGAM O43451 4/20 0.50
GAA P10253 4/20 0.50
SI P14410 4/20 0.50
MGAM2 Q2M2H8 4/20 0.50
ERN1 O75460 1/20 0.49
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
ABCG2 Q9UNQ0 1/20 0.46
ESR1 P03372 1/20 0.45
GPR84 Q9NQS5 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL20060977 0.93 LTA4H (0.70) LTA4HNR5A1MGAMGAASI
SCHEMBL20060978 0.93 LTA4H (0.70) LTA4HNR5A1MGAMGAASI
P-Cresol SCHEMBL11487367 0.90 LTA4H (0.75) LTA4HNR5A1GAAPTGS1PTGS2
SCHEMBL430765 0.88 LTA4H (0.78) LTA4HNR5A1MGAMGAASI
SCHEMBL2494388 0.86 CYP3A4 (0.55) LTA4HGAAL3MBTL1MAPTTHRB
1-Hydroxy-4-Propoxybenzene SCHEMBL56796 0.82 LTA4H (0.88) LTA4HNR5A1MGAMGAASI
Sulfur Dioxide SCHEMBL21753700 0.81 LTA4H (0.68) LTA4HNR5A1MGAMGAASI
SCHEMBL428018 0.81 LTA4H (0.78) LTA4HNR5A1ABCG2GPR84CYP3A4
SCHEMBL10703376 0.80 ACHE (0.59) LTA4HNR5A1GAAGPR84L3MBTL1
SCHEMBL10704665 0.80 LTA4H (0.84) LTA4HNR5A1MGAMGAASI

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-20180105674-A1 RESIN COMPOSITION, RESIN SHEET, RESIN CURED PRODUCT, AND RESIN SUBSTRATE TDK CORPORATION (JP) 2018-04-19 US disclosed