SCHEMBL4710939

SCHEMBL4710939

C=CCNC(=O)CN(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.56
MEP1B Q16820 5/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
GLA P06280 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 1/20 0.47
HDAC3 O15379 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC2 Q92769 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
NCOR2 Q9Y618 2/20 0.47
LMNA P02545 2/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL13603943 0.79 GAA (0.50) GAAGLAHTTRAB9ASMN1; SMN2
SCHEMBL22698650 0.79 MEP1B (0.52) MEP1BMEN1KMT2ATDP1RAB9A
SCHEMBL6631803 0.78 KCNH2 (0.58) GAAL3MBTL1MEN1KMT2AGLA
SCHEMBL27650715 0.77 MEN1 (0.60) MEP1BL3MBTL1MEN1KMT2ATDP1
SCHEMBL19474705 0.76 MEP1B (0.74) MEP1BMEN1KMT2ATDP1HDAC3
SCHEMBL4207497 0.76 MAPT (0.59) GAAL3MBTL1MEN1KMT2AHTT
SCHEMBL1290016 0.75 MEP1B (0.49) MEP1BMEN1KMT2ATDP1RAB9A
SCHEMBL9721530 0.75 MEP1B (0.55) MEP1BMEN1KMT2ATDP1HTT
SCHEMBL3190680 0.73 MEP1B (0.53) MEP1BMEN1KMT2ATDP1RAB9A
SCHEMBL17736335 0.73 CA2 (0.60) L3MBTL1MEN1KMT2AHTTRAB9A

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-1943216-A1 PROLINAMIDE DERIVATIVES AS SODIUM CHANNEL MODULATORS GLAXO GROUP LIMITED (GB) 2008-07-16 EP disclosed
WO-2007042250-A1 PROLINAMIDE DERIVATIVES AS SODIUM CHANNEL MODULATORS GLAXO GROUP LIMITED (GB) 2007-04-19 WO disclosed