SCHEMBL12636147

SCHEMBL12636147

COc1ccc(CN2C(=O)NC(=O)C2=O)cc1CN

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.47
MEN1 O00255 9/20 0.47
ALDH1A1 P00352 10/20 0.46
MAPT P10636 7/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
L3MBTL1 Q9Y468 4/20 0.45
KDM4E B2RXH2 3/20 0.45
RECQL P46063 3/20 0.45
LMNA P02545 3/20 0.45
HTT P42858 2/20 0.43
PKM P14618 2/20 0.41
POLB P06746 2/20 0.41
APEX1 P27695 2/20 0.41
PSMD14 O00487 1/20 0.41
NSD2 O96028 1/20 0.41
MMP2 P08253 1/20 0.41
DNMT1 P26358 1/20 0.41
BLM P54132 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL10341825 0.85 KMT2A (0.57) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL12635575 0.84 GAA (0.51) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL12635840 0.83 TLR7 (0.45) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL12636166 0.78 KMT2A (0.52) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL12634546 0.77 HTT (0.46) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL12635556 0.77 ALDH1A1 (0.54) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL12635627 0.76 KMT2A (0.42) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL12636186 0.75 KMT2A (0.41) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL10341830 0.75 USP2 (0.57) KMT2AMEN1ALDH1A1MAPTL3MBTL1
SCHEMBL12635557 0.74 PTGDR2 (0.47) KMT2AMEN1ALDH1A1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011078370-A1 NOVEL PARABANIC ACID DERIVATIVE AND DRUG HAVING THE SAME AS ACTIVE INGREDIENT 杏林製薬株式会社 (JP) 2011-06-30 WO disclosed