SCHEMBL4416869

SCHEMBL4416869

NNC(=O)CCN1C(=O)C(c2ccccc2)N(CCC(=O)NN)C1=O

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 4/20 0.40
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
RECQL P46063 1/20 0.38
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
NCOR2 Q9Y618 1/20 0.37
POLB P06746 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL4413710 0.75 POLB (0.43) KMT2ALMNAKDM4EMAPTPOLB
SCHEMBL293304 0.71 POLB (0.37) KMT2ALMNAKDM4EMAPTHDAC1
Ammonia Solution, Strong SCHEMBL28241761 0.70 POLB (0.36) KMT2ALMNAKDM4EMAPTHDAC1
SCHEMBL17803977 0.70 POLB (0.41) KMT2AL3MBTL1KDM4EMAPTPOLB
SCHEMBL4409652 0.69 POLB (0.63) KMT2AMEN1L3MBTL1KDM4EMAPT
SCHEMBL8722998 0.69 GAA (0.41) KMT2AMEN1LMNAKDM4EMAPT
SCHEMBL19923596 0.66 LMNA (0.50) KMT2AMEN1LMNAKDM4ECYP1A2
SCHEMBL28442559 0.66 SIGMAR1 (0.66) KMT2ALMNAPOLB
SCHEMBL19923664 0.65 EHMT2 (0.54) KMT2AMEN1HDAC1HDAC2HDAC8
SCHEMBL13933033 0.65 POLB (0.32) POLB

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