SCHEMBL8785261

SCHEMBL8785261

CCOC(=O)CN(C)C(=O)c1ccccc1C(=O)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
KDM4E B2RXH2 1/20 0.46
L3MBTL1 Q9Y468 4/20 0.42
MAPT P10636 4/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
TSHR P16473 1/20 0.40
HPGD P15428 1/20 0.39
POLB P06746 1/20 0.39
CASP3 P42574 1/20 0.39

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
SCHEMBL7853546 0.85 MAPT (0.40) LMNAKDM4EL3MBTL1MAPTMEN1
SCHEMBL7855091 0.84 LTA4H (0.40) LMNAKDM4EL3MBTL1MAPTMEN1
SCHEMBL7854914 0.81 MAPT (0.39) LMNAKDM4EL3MBTL1MAPTMEN1
SCHEMBL7850534 0.81 KDM4E (0.39) LMNAKDM4EL3MBTL1MAPTMEN1
SCHEMBL7852199 0.80 MAPT (0.38) LMNAKDM4EL3MBTL1MAPTMEN1
SCHEMBL9401553 0.79 LMNA (0.43) LMNACA12CA1CA2CA9
SCHEMBL7856970 0.78 HPGD (0.41) L3MBTL1MEN1KMT2ANPSR1HPGD
SCHEMBL7849671 0.78 ALDH1A1 (0.52) LMNAMAPTMEN1KMT2ANPSR1
SCHEMBL7851483 0.78 MAPT (0.40) LMNAKDM4EL3MBTL1MAPTMEN1
SCHEMBL7854655 0.75 HPGD (0.43) LMNAL3MBTL1MEN1KMT2ACA12

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-0585913-B1 Condensed heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-12-29 EP disclosed
US-5700810-A Condensed heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-12-23 US disclosed
US-5482967-A LOWERING CHOLESTEROL TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-01-09 US disclosed
EP-0585913-A2 Condensed heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-03-09 EP disclosed