SCHEMBL7980506

SCHEMBL7980506

CCOC(=O)CN(C(=O)C(=O)C1CNc2cc(F)ccc21)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 3/20 0.38
POLB P06746 2/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.35
GLA P06280 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
CNR1 P21554 1/20 0.34
HSD17B10 Q99714 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
USP2 O75604 3/20 0.33
PTGIR P43119 2/20 0.33

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
SCHEMBL7981921 0.88 TSHR (0.40) GAATDP1SMN1; SMN2KDM4ELMNA
SCHEMBL7992900 0.87 PTGIR (0.33) HTTPTGIR
SCHEMBL7981085 0.85 CA12 (0.34) KMT2AMEN1POLBLMNA
SCHEMBL7981280 0.85 PIN1 (0.40) KMT2AMEN1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL7969219 0.79 KMT2A (0.34) KMT2AMEN1TDP1POLB
SCHEMBL7969242 0.73 TP53 (0.41) KMT2AMEN1TDP1ALDH1A1KDM4E
SCHEMBL7944575 0.69 ALDH1A1 (0.40) TDP1ALDH1A1KDM4E
SCHEMBL4313656 0.69 TDP1 (0.51) GAAKMT2AMEN1TDP1SMN1; SMN2
SCHEMBL27601299 0.68 SMN1; SMN2 (0.51) GAAKMT2AMEN1TDP1SMN1; SMN2
SCHEMBL7944573 0.68 TDP1 (0.37) TDP1SMN1; SMN2ALDH1A1

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