SCHEMBL4392574

SCHEMBL4392574

CCOC(=O)c1cn(CC)c2ccc(CCCNCCNC(=O)OC(C)(C)C)cc2c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
HPGD P15428 4/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
POLB P06746 2/20 0.42
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 3/20 0.42
PDE4A P27815 2/20 0.42
PDE4B Q07343 2/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42
RXFP1 Q9HBX9 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
P2RX3 P56373 1/20 0.38

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
SCHEMBL5432054 0.95 LMNA (0.54) LMNAHPGDKMT2AMEN1MAPT
SCHEMBL3982430 0.95 LMNA (0.56) LMNAHPGDKMT2AMEN1MAPT
SCHEMBL4392512 0.90 ALDH1A1 (0.48) LMNAHPGDKMT2AMEN1MAPT
SCHEMBL4392504 0.90 ALDH1A1 (0.48) LMNAHPGDKMT2AMEN1POLB
SCHEMBL3818542 0.89 LMNA (0.52) LMNAHPGDKMT2AMEN1MAPT
SCHEMBL4392507 0.89 PDE4A (0.42) LMNAHPGDKMT2AMEN1MAPT
SCHEMBL4173128 0.88 LMNA (0.48) LMNAHPGDKMT2AMEN1MAPT
SCHEMBL5255090 0.87 LMNA (0.46) LMNAHPGDKMT2AMEN1MAPT
SCHEMBL5437011 0.86 LMNA (0.45) LMNAHPGDKMT2AMEN1MAPT
SCHEMBL4169502 0.85 LMNA (0.42) LMNAHPGDKMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1628990-B1 NOVEL 14 AND 15 MEMBERED RING COMPOUNDS GLAXO GROUP LTD (GB) 2009-12-02 EP disclosed
US-20070141276-A1 Novel 14 and 15 membered ring compounds GLAXO GROUP LIMITED (GB) 2007-06-21 US disclosed