SCHEMBL7686675

SCHEMBL7686675

O=[C]C(=Cc1ccc(O)c(O)c1)C(=O)C=Cc1ccc(O)c(O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.56
▸ MAPT P10636 5/20 0.56
▸ HSD17B10 Q99714 4/20 0.56
▸ KMT2A Q03164 4/20 0.56
▸ MEN1 O00255 3/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ HPGD P15428 3/20 0.56
▸ TDP1 Q9NUW8 3/20 0.56
▸ MAPK1 P28482 3/20 0.56
▸ TTR P02766 2/20 0.56
▸ APP P05067 2/20 0.56
▸ LMNA P02545 2/20 0.56
▸ POLB P06746 2/20 0.56
▸ CYP3A4 P08684 2/20 0.56
▸ APEX1 P27695 2/20 0.56
▸ PMP22 Q01453 2/20 0.56
▸ HIF1A Q16665 2/20 0.56
▸ GAA P10253 2/20 0.56
▸ PTPN1 P18031 2/20 0.56
▸ HDAC3 O15379 1/20 0.56

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
SCHEMBL2403631 0.88 GLO1 (0.67) KDM4EMAPTHSD17B10KMT2AMEN1
SCHEMBL79945 0.83 GLO1 (0.71) KDM4EMAPTHSD17B10KMT2AMEN1
SCHEMBL2910901 0.77 SNCA (0.73) KDM4EMAPTHSD17B10KMT2AMEN1
SCHEMBL7585198 0.76 HSD17B10 (0.62) KDM4EMAPTHSD17B10KMT2AMEN1
SCHEMBL2221673 0.74 KDM4E (0.74) KDM4EMAPTHSD17B10KMT2AMEN1
SCHEMBL5598948 0.74 KDM4E (0.74) KDM4EMAPTHSD17B10KMT2AMEN1
SCHEMBL6535158 0.72 TTR (0.66) KDM4EMAPTHSD17B10KMT2AMEN1
Caffeic Acid SCHEMBL7064846 0.72 KDM4E (1.00) KDM4EMAPTHSD17B10KMT2AMEN1
SCHEMBL2042662 0.72 KDM4E (0.71) KDM4EMAPTHSD17B10KMT2AMEN1
Caffeic Acid SCHEMBL1262229 0.72 KDM4E (1.00) KDM4EMAPTHSD17B10KMT2AMEN1

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
WO-2002026697-A2 AROMATIC DERIVATIVES WITH HIV INTEGRASE INHIBITORY PROPERTIES PHARMACOR, INC. (CA) 2002-04-04 — — WO disclosed
Send feedback