SCHEMBL6848256

SCHEMBL6848256

CCOC(=O)C=Cc1ccc(C=CC(=O)O)c2c(OC)ccc(OC)c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.52
MAOB P27338 1/20 0.51
HCAR2 Q8TDS4 1/20 0.47
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HPGD P15428 2/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
ALOX15 P16050 1/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
AKR1B10 O60218 3/20 0.44
AKR1B1 P15121 3/20 0.44
DPP4 P27487 2/20 0.43
BCHE P06276 2/20 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
SCHEMBL6855524 0.94 FDPS (0.57) FDPSMAOBKDM4EALDH1A1SMN1; SMN2
SCHEMBL6848311 0.87 KDM4E (0.57) KDM4EALDH1A1SMN1; SMN2HPGDCA12
SCHEMBL6848310 0.87 KDM4E (0.57) KDM4EALDH1A1SMN1; SMN2HPGDCA12
SCHEMBL6852966 0.84 HCAR2 (0.51) FDPSMAOBHCAR2KDM4EALDH1A1
SCHEMBL15669138 0.81 FDPS (0.56) FDPSMAOBKDM4EALDH1A1SMN1; SMN2
SCHEMBL12035658 0.81 FDPS (0.56) FDPSMAOBKDM4EALDH1A1SMN1; SMN2
SCHEMBL1884884 0.80 ABCG2 (0.62) FDPSMAOBALDH1A1SMN1; SMN2CA12
SCHEMBL1884886 0.80 ABCG2 (0.62) FDPSMAOBALDH1A1SMN1; SMN2CA12
SCHEMBL12036071 0.79 FDPS (0.53) FDPSMAOBKDM4EALDH1A1SMN1; SMN2
SCHEMBL30721745 0.78 FDPS (0.53) FDPSMAOBKDM4EALDH1A1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0799827-B1 ACRYLAMIDE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME KYORIN SEIYAKU KK (JP) 2004-05-12 EP disclosed
US-5786486-A ANTIMICROBIAL, ANTITUMOR AGENTS KYORIN PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed
EP-0799827-A1 ACRYLAMIDE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME KYORIN PHARMACEUTICAL CO., LTD. (JP) 1997-10-08 EP disclosed