SCHEMBL9232175

SCHEMBL9232175

COc1ccc(Cc2ccccc2COCc2ccccc2Cc2ccc(OC)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.60
MAOB P27338 1/20 0.47
ABCB1 P08183 1/20 0.46
IDO1 P14902 3/20 0.46
AGXT P21549 2/20 0.46
CYP11B1 P15538 3/20 0.44
CYP11B2 P19099 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.44
NSD2 O96028 1/20 0.44
KMT2A Q03164 1/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
SLC5A1 P13866 1/20 0.43
SLC5A2 P31639 1/20 0.43

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
SCHEMBL28251912 0.90 LTA4H (0.72) LTA4HMAOBABCB1IDO1CYP11B1
SCHEMBL2027109 0.88 LTA4H (0.69) LTA4HMAOBABCB1IDO1CYP11B1
SCHEMBL11289347 0.83 LTA4H (0.62) LTA4HMAOBIDO1CYP11B1CYP11B2
SCHEMBL6545565 0.81 LTA4H (0.60) LTA4HMAOBABCB1IDO1CYP11B1
SCHEMBL5158250 0.81 LTA4H (0.60) LTA4HMAOBABCB1IDO1CYP11B1
SCHEMBL12869627 0.81 LTA4H (0.60) LTA4HMAOBCYP11B1CYP11B2L3MBTL1
SCHEMBL28131751 0.81 LTA4H (0.64) LTA4HMAOBIDO1CYP11B1CYP11B2
SCHEMBL9281132 0.81 KCNH2 (0.44) IDO1AGXTSLC5A1SLC5A2
SCHEMBL26949212 0.81 LTA4H (0.64) LTA4HMAOBIDO1CYP11B1CYP11B2
SCHEMBL18613819 0.80 LTA4H (0.58) LTA4HMAOBIDO1AGXTCYP11B1

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
EP-0664316-A1 Polycarbonate composition having improved resistance to gamma-ray radiation TEIJIN LIMITED (JP) 1995-07-26 EP disclosed