SCHEMBL12231007

SCHEMBL12231007

CN(CC(=O)Nc1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.62
L3MBTL1 Q9Y468 3/20 0.54
CTDSP1 Q9GZU7 2/20 0.54
CASP6 P55212 2/20 0.54
PSMD14 O00487 1/20 0.54
MMP2 P08253 1/20 0.54
DNMT1 P26358 1/20 0.54
KMT2A Q03164 2/20 0.52
CASP8 Q14790 1/20 0.51
RAB9A P51151 2/20 0.49
MAPT P10636 1/20 0.49
F2 P00734 1/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49

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
SCHEMBL2565715 0.83 F2 (0.51) TDP1L3MBTL1KMT2AF2MEN1
SCHEMBL2565712 0.81 F2 (0.50) TDP1L3MBTL1KMT2ARAB9AF2
SCHEMBL7049647 0.80 MAPT (0.60) L3MBTL1MAPTALDH1A1
SCHEMBL15506017 0.80 ALDH1A1 (0.60) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL11323189 0.80 MAPT (0.56) RAB9AMAPTALDH1A1HPGD
Hydrochloric Acid SCHEMBL7053170 0.79 MAPT (0.58) L3MBTL1KMT2AMAPTMEN1ALDH1A1
SCHEMBL12376720 0.79 F2 (0.57) TDP1KMT2AF2MEN1ALDH1A1
SCHEMBL12561256 0.79 HDAC1 (0.55) TDP1KMT2AMAPTF2MEN1
SCHEMBL2282162 0.78 KMT2A (0.53) KMT2AF2MEN1ALDH1A1HPGD
SCHEMBL11606625 0.77 ALDH1A1 (0.55) TDP1L3MBTL1KMT2ARAB9AMAPT

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-2069286-B1 INHIBITORS FOR GLYT-1 HOFFMANN LA ROCHE (CH) 2012-09-19 EP claimed
EP-2069286-B1 INHIBITORS FOR GLYT-1 HOFFMANN LA ROCHE (CH) 2012-09-19 EP disclosed