SCHEMBL5224416

SCHEMBL5224416

COC(=O)c1ccc2cc(-c3ccc(-c4ccc(OC)cc4)s3)ccc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 6/20 0.56
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
HDAC6 Q9UBN7 1/20 0.53
PLAU P00749 3/20 0.52
PLG P00747 1/20 0.52
PLAT P00750 1/20 0.52
KDM4E B2RXH2 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 2/20 0.51
NPC1 O15118 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GLA P06280 1/20 0.51
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.51
CYP11B1 P15538 2/20 0.50
CYP11B2 P19099 2/20 0.50
CYP19A1 P11511 1/20 0.50
LMNA P02545 1/20 0.49
KMT2A Q03164 2/20 0.48

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
SCHEMBL5606006 0.85 CA1 (0.65) CA1CA2PLAUPLGPLAT
SCHEMBL30698055 0.85 CA1 (0.65) CA1CA2PLAUPLGPLAT
SCHEMBL5227376 0.84 PLAU (0.56) PLAUPLGPLATKDM4ESMN1; SMN2
SCHEMBL5227115 0.82 CYP19A1 (0.44) APPPLAUPLGPLATSMN1; SMN2
SCHEMBL5227109 0.82 PLAU (0.48) APPHDAC6PLAUPLGPLAT
SCHEMBL497643 0.82 HDAC6 (0.62) CA1CA2HDAC6PLAUPLG
SCHEMBL13900228 0.80 CYP11B1 (0.69) CA1CA2PLAUPLGPLAT
SCHEMBL6607611 0.80 CYP11B1 (0.42) HDAC6PLAUPLGPLATSMN1; SMN2
SCHEMBL1856468 0.78 KDM4E (0.70) CA1CA2PLAUPLGPLAT
SCHEMBL29906326 0.77 CA1 (0.50) APPCA1CA2KDM4ESMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1394158-B1 Thiophene derivatives and optical elements using the same FUJIFILM CORP (JP) 2007-03-21 EP disclosed
EP-1394158-A1 Novel compounds and optical elements using the same FUJI PHOTO FILM CO., LTD. (JP) 2004-03-03 EP disclosed