SCHEMBL7938770

SCHEMBL7938770

O=C(O)CN(C(=O)C(=O)C1CNc2ccccc21)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 1/20 0.36
AGER Q15109 3/20 0.36
MTNR1A P48039 1/20 0.36
KCNH2 Q12809 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35

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
SCHEMBL7944575 0.85 ALDH1A1 (0.40) L3MBTL1ALDH1A1KCNH2SLC6A2SLC6A4
SCHEMBL7947322 0.82 ALDH1A1 (0.40) L3MBTL1ALDH1A1
SCHEMBL7986076 0.82 HDAC1 (0.36) ALDH1A1KCNH2SLC6A2SLC6A4
SCHEMBL7946271 0.81 ATM (0.43) ALDH1A1KCNH2
SCHEMBL7938073 0.80 HRH3 (0.37) ALDH1A1
SCHEMBL7938183 0.79 ALDH1A1 (0.37) ALDH1A1MTNR1AKCNH2
SCHEMBL7945088 0.76 HDAC1 (0.38) ALDH1A1KCNH2SLC6A2SLC6A4
SCHEMBL7969135 0.75 BCHE (0.38) MTNR1AKCNH2SLC6A2SLC6A4
SCHEMBL7944087 0.75 BCHE (0.37) KCNH2SLC6A2SLC6A4
SCHEMBL13896765 0.73 MEN1 (0.41) ALDH1A1KCNH2

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
WO-2010035032-A1 CALCIUM ION CHANNEL MODULATORS & USES THEREOF LECTUS THERAPEUTICS LIMITED (GB) 2010-04-01 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