SCHEMBL4416802

SCHEMBL4416802

NNC(=O)CCN(CCC(=O)NN)c1ccc(Cc2ccc(N(CCC(=O)NN)CCC(=O)NN)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.49
HDAC6 Q9UBN7 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
POLB P06746 1/20 0.41
HIF1A Q16665 4/20 0.40
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
NFKB1 P19838 2/20 0.40
THPO P40225 2/20 0.40
PMP22 Q01453 2/20 0.40
CYP2D6 P10635 2/20 0.40
GMNN O75496 1/20 0.40
GABRA1 P14867 1/20 0.40
TSHR P16473 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
SLCO1B3 Q9NPD5 1/20 0.40
CYP3A4 P08684 4/20 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
SCHEMBL4397006 0.83 L3MBTL1 (0.42) AOC3HDAC6L3MBTL1ALDH1A1LMNA
SCHEMBL4248111 0.83 AOC3 (0.45) AOC3HDAC6L3MBTL1POLBALDH1A1
SCHEMBL4251995 0.83 ALDH1A1 (0.47) AOC3HDAC6L3MBTL1POLBALDH1A1
SCHEMBL4247537 0.82 L3MBTL1 (0.58) AOC3L3MBTL1HIF1AALDH1A1LMNA
SCHEMBL4245848 0.79 CA1 (0.51) AOC3HDAC6L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL2117009 0.75 HDAC6 (0.77) AOC3HDAC6HIF1AALDH1A1SMN1; SMN2
SCHEMBL11792163 0.73 L3MBTL1 (0.51) AOC3L3MBTL1ALDH1A1SMN1; SMN2MAPT
SCHEMBL4409653 0.70 POLB (0.46) L3MBTL1POLBHIF1AALDH1A1LMNA
SCHEMBL1432995 0.70 AOC3 (0.78) AOC3L3MBTL1
SCHEMBL4416799 0.70 L3MBTL1 (0.44) L3MBTL1HIF1AALDH1A1LMNAMAPT

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-7638565-B2 Polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2009-12-29 US disclosed
US-20070054998-A1 Polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2007-03-08 US disclosed
EP-1686156-A1 POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-08-02 EP disclosed