SCHEMBL4578063

SCHEMBL4578063

Oc1c(O)c2ncccc2c2ncccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.55
HSP90AA1 P07900 8/20 0.55
HTT P42858 7/20 0.55
MEN1 O00255 6/20 0.55
KMT2A Q03164 6/20 0.55
SMN1; SMN2 Q16637 6/20 0.55
LMNA P02545 6/20 0.55
TDP1 Q9NUW8 5/20 0.55
MAPT P10636 5/20 0.55
TP53 P04637 4/20 0.55
ALDH1A1 P00352 4/20 0.55
SLC6A2 P23975 4/20 0.55
ALOX15 P16050 3/20 0.55
USP2 O75604 3/20 0.55
MMP14 P50281 3/20 0.55
CYP3A4 P08684 2/20 0.55
ALOX12 P18054 2/20 0.55
OPRK1 P41145 2/20 0.55
HPGD P15428 2/20 0.55
MAPK1 P28482 2/20 0.55

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
SCHEMBL687239 0.88 HSP90AA1 (0.58) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL3241364 0.88 KDM4E (0.61) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL5473648 0.83 HSP90AA1 (0.62) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL13313358 0.81 KDM4E (0.59) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL18583574 0.81 HSP90AA1 (0.57) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL12747809 0.81 KDM4E (0.59) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL13313357 0.81 HSP90AA1 (0.59) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL13313356 0.81 HSP90AA1 (0.63) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL13271287 0.81 KDM4E (0.50) KDM4EHSP90AA1HTTMEN1KMT2A
SCHEMBL5470672 0.80 HSP90AA1 (0.59) KDM4EHSP90AA1HTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1946397-A2 ENZYMES IMMOBILIZED IN HYDROPHOBICALLY MODIFIED POLYSACCHARIDES ST. LOUIS UNIVERSITY (US) 2008-07-23 EP disclosed
WO-2007056666-A9 ENZYMES IMMOBILIZED IN HYDROPHOBICALLY MODIFIED POLYSACCHARIDES UNIV ST LOUIS (US) 2007-11-01 WO disclosed
WO-2007056666-A2 ENZYMES IMMOBILIZED IN HYDROPHOBICALLY MODIFIED POLYSACCHARIDES ST. LOUIS UNIVERSITY (US) 2007-05-18 WO disclosed
WO-2002102861-A2 PROCESS FOR THE (CO)POLYMERIZATION OF CONJUGATED DIENES ENI S.P.A. (IT) 2002-12-27 WO disclosed