SCHEMBL3411734

SCHEMBL3411734

CCOC(=O)c1c(=O)[nH]n2c(=O)c3c([nH]c12)CCCC3

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.58
MAPT P10636 9/20 0.50
KMT2A Q03164 8/20 0.50
POLB P06746 7/20 0.50
MEN1 O00255 7/20 0.50
HPGD P15428 6/20 0.50
KDM4E B2RXH2 5/20 0.50
TDP1 Q9NUW8 4/20 0.50
HTT P42858 3/20 0.50
CRHBP P24387 2/20 0.50
CRHR2 Q13324 2/20 0.50
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.41
USP2 O75604 1/20 0.40
ALDH1A1 P00352 4/20 0.40
GAA P10253 4/20 0.40
NPSR1 Q6W5P4 2/20 0.40
BLM P54132 2/20 0.40
CTDSP1 Q9GZU7 2/20 0.40

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
SCHEMBL3407592 0.83 MAPT (0.50) LMNAMAPTKMT2APOLBMEN1
SCHEMBL3408224 0.80 MAPT (0.50) LMNAMAPTKMT2APOLBMEN1
SCHEMBL1062502 0.74 LMNA (1.00) LMNAMAPTKMT2APOLBMEN1
SCHEMBL1060657 0.73 LMNA (0.73) LMNAMAPTKMT2APOLBMEN1
SCHEMBL6495433 0.71 LMNA (0.67) LMNAMAPTKMT2APOLBMEN1
SCHEMBL3407318 0.71 ALDH1A1 (0.53) LMNAMAPTKMT2AMEN1HPGD
SCHEMBL3410031 0.71 MAPT (0.52) LMNAMAPTKMT2APOLBMEN1
SCHEMBL3408312 0.71 TDP1 (0.49) LMNAMAPTKMT2APOLBMEN1
SCHEMBL3409245 0.70 MEN1 (0.50) LMNAMAPTKMT2APOLBMEN1
SCHEMBL14499342 0.70 POLB (0.76) LMNAMAPTKMT2APOLBMEN1

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-2264035-A1 Glycine B antagonists Merz Pharma GmbH & Co. KGaA (DE) 2010-12-22 EP claimed
EP-2264035-A1 Glycine B antagonists Merz Pharma GmbH & Co. KGaA (DE) 2010-12-22 EP disclosed