SCHEMBL4313656

SCHEMBL4313656

CCOC(=O)CN(C(=O)C(=O)c1c[nH]c2cc(F)ccc12)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.41
HAT1 O14929 1/20 0.40
EP300 Q09472 1/20 0.40
POLB P06746 2/20 0.39
GABRA1 P14867 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA3 P34903 1/20 0.39
GABRA2 P47869 1/20 0.39
GABRB2 P47870 1/20 0.39
PKM P14618 1/20 0.38

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
SCHEMBL4320457 0.87 MAPT (0.49) TDP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL4310933 0.86 GABRP (0.42) KDM4EHAT1EP300GABRA1GABRG2
SCHEMBL4302329 0.84 ACHE (0.42) TDP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL4304075 0.84 ALDH1A1 (0.42) TDP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL1557626 0.77 ALDH1A1 (0.47) MEN1KMT2AALDH1A1MAPTGABRA1
SCHEMBL4310271 0.76 ALDH1A1 (0.41) TDP1ALDH1A1MAPTGABRA1GABRG2
SCHEMBL4311420 0.75 MAPT (0.54) MEN1GAAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL22864631 0.74 NR4A2 (0.54) MEN1KMT2AALDH1A1KDM4EGABRA1
SCHEMBL29800593 0.74 NR4A2 (0.54) MEN1KMT2AALDH1A1KDM4EGABRA1
SCHEMBL4320477 0.72 MAPT (0.47) MEN1KMT2AALDH1A1KDM4EMAPT

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
WO-2009133387-A1 INDOLE- 3 -GLYOXYLAMIDE DERIVATIVES FOR USE AS CALCIUM ION CHANNEL MODULATORS LECTUS THERAPEUTICS LIMITED (GB) 2009-11-05 WO claimed
WO-2009133387-A1 INDOLE- 3 -GLYOXYLAMIDE DERIVATIVES FOR USE AS CALCIUM ION CHANNEL MODULATORS LECTUS THERAPEUTICS LIMITED (GB) 2009-11-05 WO disclosed
WO-2009133387-A1 INDOLE- 3 -GLYOXYLAMIDE DERIVATIVES FOR USE AS CALCIUM ION CHANNEL MODULATORS LECTUS THERAPEUTICS LIMITED (GB) 2009-11-05 WO disclosed