SCHEMBL7785565

SCHEMBL7785565

COc1ccc(Nc2cccc(Nc3c(OC)c(=O)c3=O)c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
POLB P06746 3/20 0.60
ALDH1A1 P00352 2/20 0.51
RAB9A P51151 4/20 0.50
NPC1 O15118 3/20 0.50
MAPT P10636 3/20 0.50
MAPK1 P28482 3/20 0.50
KDM4E B2RXH2 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GAA P10253 1/20 0.50
THRB P10828 1/20 0.50
RECQL P46063 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
MTNR1B P49286 3/20 0.47
MTNR1A P48039 2/20 0.47
APP P05067 1/20 0.47
EGFR P00533 1/20 0.45
SRC P12931 1/20 0.45

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
SCHEMBL2773108 0.89 MAPT (0.57) KMT2AMEN1POLBALDH1A1RAB9A
SCHEMBL2990917 0.86 KMT2A (0.81) KMT2AMEN1POLBRAB9ANPC1
SCHEMBL13302357 0.82 RAB9A (0.74) KMT2AMEN1POLBALDH1A1RAB9A
SCHEMBL2993822 0.81 POLB (0.51) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL31296648 0.79 MEN1 (0.55) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL31296647 0.79 MEN1 (0.55) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL2773250 0.79 MEN1 (0.55) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL26116957 0.79 MEN1 (0.55) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL30115032 0.77 MEN1 (0.53) KMT2AMEN1POLBRAB9ANPC1
SCHEMBL25501940 0.76 CYP1A2 (0.50) KMT2AMEN1POLBALDH1A1RAB9A

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
US-6329405-B1 AS ILEAL BILE ACID TRANSPORTER INHIBITOR, FOR THERAPY OF HYPERLIPEMIA SANKYO COMPANY, LIMITED (JP) 2001-12-11 US disclosed
CN-1287117-A Cyclobutene derivatives, preparation method and therapeutic use thereof SANKYO CO (JP) 2001-03-14 CN disclosed
EP-1070703-A1 Cyclobutene derivatives Sankyo Company Limited (JP) 2001-01-24 EP disclosed